Exact Mass: 136.0497

Exact Mass Matches: 136.0497

Found 189 metabolites which its exact mass value is equals to given mass value 136.0497, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

2-Hydroxyacetophenone

2-Hydroxy-1-phenylethan-1-one

C8H8O2 (136.0524)


2-Hydroxyacetophenone is a principal root volatile of the Carissa edulis[1]. 2-Hydroxyacetophenone shows inhibitory effects on infection of HIV/SARS-CoV S pseudovirus with an IC50 of 1.8 mM[2]. 2-Hydroxyacetophenone is a principal root volatile of the Carissa edulis[1]. 2-Hydroxyacetophenone shows inhibitory effects on infection of HIV/SARS-CoV S pseudovirus with an IC50 of 1.8 mM[2].

   

2-Methylbenzoic acid

2-Toluic acid, sodium salt, 11C-labeled

C8H8O2 (136.0524)


o-Toluic acid, also 2-methylbenzoic acid, is an aromatic carboxylic acid, with formula (CH3)C6H4(COOH). -- Wikipedia; It is an isomer of p-toluic acid and m-toluic acid. -- Wikipedia KEIO_ID T038 o-Toluic acid (2-Methylbenzoic acid) is a benzoic acid?substituted by a?methyl?group at position 2. O-Toluic acid plays a role as a xenobiotic metabolite.

   

4-Methylbenzoic acid

4-Toluic acid, potassium salt

C8H8O2 (136.0524)


4-Methylbenzoic acid is found in brassicas. 4-Methylbenzoic acid is isolated from horseradis KEIO_ID M017 p-Toluic acid (4-Methylbenzoic acid) is a substituted?benzoic acid?and can be used as an intermediate for the synthesis of para-aminomethylbenzoic acid (PAMBA), p-tolunitrile, etc. p-Toluic acid (4-Methylbenzoic acid) is a substituted?benzoic acid?and can be used as an intermediate for the synthesis of para-aminomethylbenzoic acid (PAMBA), p-tolunitrile, etc.

   

Phenylacetic acid

Phenylacetic acid, sodium salt , carboxy-(11)C-labeled CPD

C8H8O2 (136.0524)


Phenylacetic acid, also known as phenylacetate or alpha-toluic acid, belongs to benzene and substituted derivatives class of compounds. Those are aromatic compounds containing one monocyclic ring system consisting of benzene. Phenylacetic acid is slightly soluble (in water) and a weakly acidic compound (based on its pKa). Phenylacetic acid can be synthesized from acetic acid. Phenylacetic acid is also a parent compound for other transformation products, including but not limited to, hydratropic acid, 2,4,5-trihydroxyphenylacetic acid, and mandelamide. Phenylacetic acid is a sweet, civet, and floral tasting compound and can be found in a number of food items such as hyssop, cowpea, endive, and shea tree, which makes phenylacetic acid a potential biomarker for the consumption of these food products. Phenylacetic acid can be found primarily in most biofluids, including cerebrospinal fluid (CSF), saliva, feces, and blood. Phenylacetic acid exists in all living species, ranging from bacteria to humans. In humans, phenylacetic acid is involved in the phenylacetate metabolism. Moreover, phenylacetic acid is found to be associated with kidney disease and phenylketonuria. Phenylacetic acid is a non-carcinogenic (not listed by IARC) potentially toxic compound. Phenylacetic acid is a drug which is used for use as adjunctive therapy for the treatment of acute hyperammonemia and associated encephalopathy in patients with deficiencies in enzymes of the urea cycle. Phenyl acetate (or phenylacetate) is a carboxylic acid ester that has been found in the biofluids of patients with nephritis and/or hepatitis as well as patients with phenylketonuria (PKU), an inborn error of metabolism. Phenyl acetate has been identified as a uremic toxin according to the European Uremic Toxin Working Group (PMID: 22626821). Excess phenylalanine in the body can be disposed of through a transamination process leading to the production of phenylpyruvate. The phenylpyruvate can be further metabolized into a number of products. Decarboxylation of phenylpyruvate gives phenylacetate, while a reduction reaction gives phenyllactate. The phenylacetate can be further conjugated with glutamine to give phenylacetyl glutamine. All of these metabolites can be detected in serum and urine of PKU patients. Phenyl acetate is also produced endogenously as the metabolite of 2-Phenylethylamine, which is mainly metabolized by monoamine oxidase to form phenyl acetate. 2-phenylethylamine is an "endogenous amphetamine" which may modulate central adrenergic functions, and the urinary phenyl acetate levels have been postulated as a marker for depression. (PMID: 17978765 , 476920 , 6857245). Phenylacetate is also found in essential oils, e.g. neroli, rose oil, free and as esters and in many fruits. As a result it is used as a perfumery and flavoring ingredient. Phenyl acetate is a microbial metabolite. D009676 - Noxae > D000963 - Antimetabolites D000970 - Antineoplastic Agents

   

4-Methoxybenzaldehyde

4-anisaldehyde, 1,2,3,4,5,6-(14)C6-labeled

C8H8O2 (136.0524)


4-Methoxybenzaldehyde, also known as 4-anisaldehyde or p-formylanisole, belongs to the class of organic compounds known as benzoyl derivatives, with the chemical formula CH3OC6H4CHO. These are organic compounds containing an acyl moiety of benzoic acid with the formula (C6H5CO-). Anisaldehyde is prepared commercially by oxidation of 4-methoxytoluene (p-cresyl methyl ether) using manganese dioxide to convert a methyl group to the aldehyde group. 4-Methoxybenzaldehyde is a sweet, almond, and anise tasting compound. 4-Methoxybenzaldehyde can be found, on average, in the highest concentration within a few different foods, such as cumins, star anises, and fennels. 4-Methoxybenzaldehyde has also been detected, but not quantified, in several different foods, such as cornmints, anises, herbs and spices, tarragons, and tea. The related ortho isomer has a scent of licorice. It is a colorless liquid with a strong aroma. A solution of para-anisaldehyde in acid and ethanol is a useful stain in thin layer chromatography. Different chemical compounds on the plate can give different colors, allowing easy distinction. It is used as an intermediate in the synthesis of other compounds important in pharmaceuticals and perfumery. Found in anise oil, fennel and vanilla. Flavouring ingredient 4-Methoxybenzaldehyde is a naturally occurring fragrant phenolic compound. 4-Methoxybenzaldehyde has been found in many plant species including horseradish, anise, star anise. 4-Methoxybenzaldehyde is a possible neurotoxicant and it has shown effects that include mortality, attractancy, and interference with host seeking [1]. 4-Methoxybenzaldehyde is a naturally occurring fragrant phenolic compound. 4-Methoxybenzaldehyde has been found in many plant species including horseradish, anise, star anise. 4-Methoxybenzaldehyde is a possible neurotoxicant and it has shown effects that include mortality, attractancy, and interference with host seeking [1].

   

M-toluic Acid

beta-Bethylbenzoic acid

C8H8O2 (136.0524)


M-toluic Acid, also known as beta-Bethylbenzoic acid or m-Toluate, is classified as a member of the Benzoic acids. Benzoic acids are organic Compounds containing a benzene ring which bears at least one carboxyl group. M-toluic Acid is considered to be slightly soluble (in water) and acidic CONFIDENCE standard compound; INTERNAL_ID 802; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4069; ORIGINAL_PRECURSOR_SCAN_NO 4066 CONFIDENCE standard compound; INTERNAL_ID 802; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3095; ORIGINAL_PRECURSOR_SCAN_NO 3093 CONFIDENCE standard compound; INTERNAL_ID 802; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3109; ORIGINAL_PRECURSOR_SCAN_NO 3105 CONFIDENCE standard compound; INTERNAL_ID 802; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3097; ORIGINAL_PRECURSOR_SCAN_NO 3094 KEIO_ID M018

   

Acetylphenol

Acetic acid,phenyl ester

C8H8O2 (136.0524)


C274 - Antineoplastic Agent > C2122 - Cell Differentiating Agent > C1934 - Differentiation Inducer Phenyl acetate is an endogenous metabolite.

   

4-Hydroxyphenylacetaldehyde

2-(4-Hydroxyphenyl)acetaldehyde

C8H8O2 (136.0524)


4-Hydroxyphenylacetaldehyde is a byproduct of tyrosine metabolism. COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

   

Benzyl formate

Formic acid, phenylmethyl ester

C8H8O2 (136.0524)


Benzyl formate, also known as benzyl methanoate or BZO, belongs to the class of organic compounds known as benzyloxycarbonyls. These are organic compounds containing a carbonyl group substituted with a benzyloxyl group. Benzyl formate is an extremely weak basic (essentially neutral) compound (based on its pKa). Benzyl formate is an almond, apricot, and black tea tasting compound. Benzyl formate is found in coffee and coffee products. Benzyl formate occurs in essential oils. Benzyl formate is present in sour cherry, crowberry, Vaccinium species fruits, coffee, black tea, yellow passion fruit, Ocimum basilicum varieties, and other foods. Benzyl formate is used in perfumery and food flavouring. Benzyl formate occurs in essential oils. It is found in sour cherry, crowberry, Vaccinium spp. fruits, coffee, black tea, yellow passion fruit, Ocimum basilicum varieties and other foods. Used in perfumery and food flavouring.

   

3,4-Dihydroxystyrene

4-Vinylbenzene-1,2-diol

C8H8O2 (136.0524)


   

3-Vinylcatechol

2,3-Dihydroxy Styrene

C8H8O2 (136.0524)


   

piceol

InChI=1\C8H8O2\c1-6(9)7-2-4-8(10)5-3-7\h2-5,10H,1H

C8H8O2 (136.0524)


INTERNAL_ID 214; CONFIDENCE standard compound; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3089; ORIGINAL_PRECURSOR_SCAN_NO 3087 CONFIDENCE standard compound; INTERNAL_ID 214; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3087; ORIGINAL_PRECURSOR_SCAN_NO 3084 CONFIDENCE standard compound; INTERNAL_ID 214; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3098; ORIGINAL_PRECURSOR_SCAN_NO 3095 CONFIDENCE standard compound; INTERNAL_ID 214; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3092; ORIGINAL_PRECURSOR_SCAN_NO 3090 CONFIDENCE standard compound; INTERNAL_ID 214; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3089; ORIGINAL_PRECURSOR_SCAN_NO 3087 CONFIDENCE standard compound; INTERNAL_ID 214; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3095; ORIGINAL_PRECURSOR_SCAN_NO 3093 INTERNAL_ID 214; CONFIDENCE standard compound; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3092; ORIGINAL_PRECURSOR_SCAN_NO 3090 CONFIDENCE standard compound; INTERNAL_ID 214; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3160; ORIGINAL_PRECURSOR_SCAN_NO 3158 4-Hydroxyacetophenone (P-hydroxyacetophenone) is a key hepatoprotective and choleretic compound in Artemisia capillaris and A. morrisonensis, also has an anti-hepatitis B virus effect and anti-inflammatory effect[1]. 4-Hydroxyacetophenone (P-hydroxyacetophenone) is a key hepatoprotective and choleretic compound in Artemisia capillaris and A. morrisonensis, also has an anti-hepatitis B virus effect and anti-inflammatory effect[1].

   

3-Methylsalicylaldehyde

2-Hydroxy-3-methylbenzaldehyde

C8H8O2 (136.0524)


   

Methyl benzoate

Methyl benzenecarboxylic acid

C8H8O2 (136.0524)


Methyl benzoate is an ester with the chemical formula C6H5COOCH3. It is formed by the condensation of methanol and benzoic acid. It is a colorless to slightly yellow liquid that is insoluble with water, but miscible with most organic solvents. Methyl benzoate is found in allspice. Methyl benzoate is present in various flower oils, banana, cherry, pimento berry, ceriman (Monstera deliciosa), clove bud and stem, mustard, coffee, black tea, dill, starfruit and cherimoya (Annona cherimola). Methyl benzoate is used in flavourings. It is one of many compounds that is attractive to males of various species of orchid bees, who apparently gather the chemical to synthesize pheromones; it is commonly used as bait to attract and collect these bees for study. Present in various flower oils, banana, cherry, pimento berry, ceriman (Monstera deliciosa), clove bud and stem, mustard, coffee, black tea, dill, starfruit and cherimoya (Annona cherimola). It is used in flavourings

   

4-Hydroxy-3-methylbenzaldehyde

4-Hydroxy-3-methylbenzaldehyde

C8H8O2 (136.0524)


   

Phenyl acetate

Phenyl ester OF acetic acid

C8H8O2 (136.0524)


Phenyl acetate, also known as acetylphenol, is an aromatic fatty acid metabolite of phenylalanine with potential antineoplastic activity. Naturally occurring in mammals, phenylacetate induces differentiation, growth inhibition, and apoptosis in tumor cells. Its mechanisms of action include decreased protein prenylation, activation of the peroxisome proliferation-activated receptors, inhibition of DNA methylation, and depletion of glutamine. Phenyl acetate belongs to the class of organic compounds known as phenol esters. These are aromatic compounds containing a benzene ring substituted by a hydroxyl group and an ester group. Phenyl acetate has a phenolic-like taste. Flavouring ingredient in baked goods and candies Phenyl acetate is an endogenous metabolite.

   

2-Methoxybenzaldehyde

o-Anisaldehyde, United States Pharmacopeia (USP) Reference Standard

C8H8O2 (136.0524)


2-Methoxybenzaldehyde is found in Chinese cinnamon. 2-Methoxybenzaldehyde is present in cinnamon (Cinnamomum zeylanicum). 2-Methoxybenzaldehyde is a flavouring ingredient. Anisaldehyde, or anisic aldehyde, is an organic compound that consists of a benzene ring substituted with an aldehyde and a methoxy group. It is a clear colorless liquid with a strong aroma. It comes in 3 varieties, ortho, meta, and para in which the two functional groups (methoxy and aldehyde) are alpha, beta, and gamma, respectively to each other. The unmodified term anisaldehyde generally refers to the para isomer. Anisaldehyde is found in anise, from which it gets its name. It is similar in structure to vanillin. (Wikipedia). Present in cinnamon (Cinnamomum zeylanicum). Flavouring ingredient 2-Methoxybenzaldehyde is a carbonyl compound. 2-Methoxybenzaldehyde (o-Anisaldehyde), isolated from cinnamon essential oil (CEO), exists antibacterial and antifungal activity[1]. 2-Methoxybenzaldehyde (o-Anisaldehyde), isolated from cinnamon essential oil (CEO), exists antibacterial and antifungal activity[1].

   

AI3-15121

InChI=1/C8H8O2/c9-6-8(10)7-4-2-1-3-5-7/h1-5,9H,6H

C8H8O2 (136.0524)


2-hydroxyacetophenone is a monohydroxyacetophenone that is acetophenone in which one of the methyl hydrogens has been replaced by a hydroxy group. It is a primary alcohol, a primary alpha-hydroxy ketone and a monohydroxyacetophenone. 2-Hydroxyacetophenone is a natural product found in Carissa spinarum, Scutellaria baicalensis, and Carissa edulis with data available. 2-Hydroxyacetophenone is a principal root volatile of the Carissa edulis[1]. 2-Hydroxyacetophenone shows inhibitory effects on infection of HIV/SARS-CoV S pseudovirus with an IC50 of 1.8 mM[2]. 2-Hydroxyacetophenone is a principal root volatile of the Carissa edulis[1]. 2-Hydroxyacetophenone shows inhibitory effects on infection of HIV/SARS-CoV S pseudovirus with an IC50 of 1.8 mM[2].

   

3-Methoxybenzaldehyde

InChI=1/C8H8O2/c1-10-8-4-2-3-7(5-8)6-9/h2-6H,1H

C8H8O2 (136.0524)


3-Methoxybenzaldehyde is found in cloves. Anisaldehyde, or anisic aldehyde, is an organic compound that consists of a benzene ring substituted with an aldehyde and a methoxy group. It is a clear colorless liquid with a strong aroma. It comes in 3 varieties, ortho, meta, and para in which the two functional groups (methoxy and aldehyde) are alpha, beta, and gamma, respectively to each other. The unmodified term anisaldehyde generally refers to the para isomer. Anisaldehyde is found in anise, from which it gets its name. It is similar in structure to vanillin. (Wikipedia Anisaldehyde, or anisic aldehyde, is an organic compound that consists of a benzene ring substituted with an aldehyde and a methoxy group. It is a clear colorless liquid with a strong aroma. It comes in 3 varieties, ortho, meta, and para in which the two functional groups (methoxy and aldehyde) are alpha, beta, and gamma, respectively to each other. The unmodified term anisaldehyde generally refers to the para isomer. Anisaldehyde is found in anise, from which it gets its name. It is similar in structure to vanillin. 3-methoxybenzaldehyde is a member of the class of benzaldehydes in which the hydrogen at position 3 of benzaldehyde has been replaced by a methoxy group. It has a role as a Brassica napus metabolite. It is a member of benzaldehydes and a monomethoxybenzene. 3-Methoxybenzaldehyde is a natural product found in Syzygium aromaticum with data available. A member of the class of benzaldehydes in which the hydrogen at position 3 of benzaldehyde has been replaced by a methoxy group. m-Anisaldehyde is an endogenous metabolite. m-Anisaldehyde is an endogenous metabolite.

   

2'-Hydroxyacetophenone

1-(2-Hydroxyphenyl)ethanone; Paracetamol Imp. I (EP); 2-Hydroxyacetophenone; Paracetamol Impurity I

C8H8O2 (136.0524)


2-Hydroxyacetophenone, also known as 2-acetylphenol or 2-hydroxyacetylbenzene, belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group. 2-Hydroxyacetophenone is a sweet, hawthorne, and herbal tasting compound. 2-hydroxyacetophenone has been detected, but not quantified, in several different foods, such as chinese cinnamons, tea, coffee and coffee products, alcoholic beverages, and garden tomato. 2-acetylphenol is a monohydroxyacetophenone that is acetophenone in which one of the hydrogens ortho to the acetyl group has been replaced by a hydroxy group. It has a role as a flavouring agent. It is a monohydroxyacetophenone and a member of phenols. 2-Hydroxyacetophenone is a natural product found in Castanopsis cuspidata, Mangifera indica, and other organisms with data available. Present in tomato, cassia (Cinnamomum cassia), fried beef, rum, whiskey, cocoa, coffee and black tea. Flavouring ingredient. 2-Hydroxyacetophenone is found in many foods, some of which are garden tomato, tea, chinese cinnamon, and herbs and spices. 2'-Hydroxyacetophenone is found in alcoholic beverages. 2'-Hydroxyacetophenone is present in tomato, cassia, fried beef, rum, whiskey, cocoa, coffee and black tea. 2'-Hydroxyacetophenone is a flavouring ingredient. Building block in chemical synthesis. 2'-Hydroxyacetophenone is found in alcoholic beverages. 2'-Hydroxyacetophenone is present in tomato, cassia, fried beef, rum, whiskey, cocoa, coffee and black tea. 2'-Hydroxyacetophenone is a flavouring ingredient. Building block in chemical synthesis.

   

2-Hydroxy-4-methylbenzaldehyde

2-Hydroxy-4-methyl-benzaldehyde

C8H8O2 (136.0524)


2-Hydroxy-4-methylbenzaldehyde is a flavouring ingredien Flavouring ingredient 2-Hydroxy-4-methylbenzaldehyde is an endogenous metabolite.

   

4-vinylresorcinol

4-vinylresorcinol

C8H8O2 (136.0524)


   

3-(3-Furanyl)-2-methyl-2-propenal

(2Z)-3-(furan-3-yl)-2-methylprop-2-enal

C8H8O2 (136.0524)


3-(3-Furanyl)-2-methyl-2-propenal is found in pulses. 3-(3-Furanyl)-2-methyl-2-propenal is a constituent of the aroma of carob bean (Ceratonia siliqua). Constituent of the aroma of carob bean (Ceratonia siliqua). 3-(3-Furanyl)-2-methyl-2-propenal is found in pulses.

   

3-(5-Methyl-2-furyl)prop-2-enal

(e)-2-Methyl-3-(5-methyl-2-furyl)prop-2-enal

C8H8O2 (136.0524)


3-(5-Methyl-2-furyl)prop-2-enal is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]")

   

4-(2-Furanyl)-3-buten-2-one

3-Buten-2-one, 4-(2-furyl)-, polymers (8ci)

C8H8O2 (136.0524)


4-(2-Furanyl)-3-buten-2-one is found in alcoholic beverages. 4-(2-Furanyl)-3-buten-2-one is present in rum and coffee. 4-(2-Furanyl)-3-buten-2-one is a flavouring agent. Present in rum and coffee. Flavouring agent. 4-(2-Furanyl)-3-buten-2-one is found in alcoholic beverages and coffee and coffee products.

   

alpha-Methyl-2-furanacrolein

(2E)-3-(furan-2-yl)-2-methylprop-2-enal

C8H8O2 (136.0524)


alpha-Methyl-2-furanacrolein is found in fats and oils. alpha-Methyl-2-furanacrolein is a flavouring ingredient. alpha-Methyl-2-furanacrolein is a constituent of roasted sesame seed oil. Flavouring ingredient. Constituent of roasted sesame seed oil. alpha-Methyl-2-furanacrolein is found in fats and oils.

   

1,4-Benzodioxane

2,3-dihydro-1,4-benzodioxine

C8H8O2 (136.0524)


   

Oxonol

oxonin-2-ol

C8H8O2 (136.0524)


   

4-aminobenzoate

4-Aminobenzoic acid, ion(1-)

C7H6NO2- (136.0399)


4-aminobenzoate, also known as para-aminobenzoic acid or paba, is a member of the class of compounds known as aminobenzoic acids. Aminobenzoic acids are benzoic acids containing an amine group attached to the benzene moiety. 4-aminobenzoate is soluble (in water) and a weakly acidic compound (based on its pKa). 4-aminobenzoate can be found in a number of food items such as babassu palm, nectarine, java plum, and black cabbage, which makes 4-aminobenzoate a potential biomarker for the consumption of these food products. Aminobenzoic acid (a benzoic acid with an amino group) can refer to: 4-Aminobenzoic acid (p-aminobenzoic acid or para-aminobenzoic acid) 3-Aminobenzoic acid (m-aminobenzoic acid or meta-aminobenzoic acid) 2-aminobenzoic acid (o-aminobenzoic acid or ortho-aminobenzoic acid, Anthranilic acid) .

   

PHENYLACETIC ACID

2-phenylacetic acid

C8H8O2 (136.0524)


D009676 - Noxae > D000963 - Antimetabolites D000970 - Antineoplastic Agents

   

4-Methoxybenzaldehyde

p-Anisaldehyde, United States Pharmacopeia (USP) Reference Standard

C8H8O2 (136.0524)


4-Methoxybenzaldehyde, also known as 4-anisaldehyde or p-formylanisole, belongs to the class of organic compounds known as benzoyl derivatives, with the chemical formula CH3OC6H4CHO. These are organic compounds containing an acyl moiety of benzoic acid with the formula (C6H5CO-). Anisaldehyde is prepared commercially by oxidation of 4-methoxytoluene (p-cresyl methyl ether) using manganese dioxide to convert a methyl group to the aldehyde group. 4-Methoxybenzaldehyde is a sweet, almond, and anise tasting compound. 4-Methoxybenzaldehyde can be found, on average, in the highest concentration within a few different foods, such as cumins, star anises, and fennels. 4-Methoxybenzaldehyde has also been detected, but not quantified, in several different foods, such as cornmints, anises, herbs and spices, tarragons, and tea. The related ortho isomer has a scent of licorice. It is a colorless liquid with a strong aroma. A solution of para-anisaldehyde in acid and ethanol is a useful stain in thin layer chromatography. Different chemical compounds on the plate can give different colors, allowing easy distinction. It is used as an intermediate in the synthesis of other compounds important in pharmaceuticals and perfumery. P-methoxybenzaldehyde is a member of the class of benzaldehydes consisting of benzaldehyde itself carrying a methoxy substituent at position 4. It has a role as an insect repellent, a human urinary metabolite, a plant metabolite and a bacterial metabolite. 4-Methoxybenzaldehyde is a natural product found in Vanilla pompona, Solidago odora, and other organisms with data available. See also: Anise Oil (part of). Found in anise oil, fennel and vanilla. Flavouring ingredient 4-Methoxybenzaldehyde is a naturally occurring fragrant phenolic compound. 4-Methoxybenzaldehyde has been found in many plant species including horseradish, anise, star anise. 4-Methoxybenzaldehyde is a possible neurotoxicant and it has shown effects that include mortality, attractancy, and interference with host seeking [1]. 4-Methoxybenzaldehyde is a naturally occurring fragrant phenolic compound. 4-Methoxybenzaldehyde has been found in many plant species including horseradish, anise, star anise. 4-Methoxybenzaldehyde is a possible neurotoxicant and it has shown effects that include mortality, attractancy, and interference with host seeking [1].

   

3-ACETYLPHENOL

3-Hydroxyacetophenone

C8H8O2 (136.0524)


3-Hydroxyacetophenone (m-Hydroxyacetophenone) is the hydroxy-substituted alkyl phenyl ketone that can be used in synthesis of enantiopure (-)-rivastigmine[1][2]. 3-Hydroxyacetophenone (m-Hydroxyacetophenone) is the hydroxy-substituted alkyl phenyl ketone that can be used in synthesis of enantiopure (-)-rivastigmine[1][2].

   

METHYL BENZOATE

METHYL BENZOATE

C8H8O2 (136.0524)


A benzoate ester obtained by condensation of benzoic acid and methanol.

   

m-Anisaldehyde

m-Methoxybenzaldehyde

C8H8O2 (136.0524)


m-Anisaldehyde is an endogenous metabolite. m-Anisaldehyde is an endogenous metabolite.

   

2,3-Dimethylquinone

2,3-Dimethylquinone

C8H8O2 (136.0524)


   

2,5-Dimethyl-1,4-benzoquinone

2,5-Dimethyl-1,4-benzoquinone

C8H8O2 (136.0524)


   

1-phenylethene-1,2-diol

1-phenylethene-1,2-diol

C8H8O2 (136.0524)


   

(E)- 6-(1-Propenyl)-2H-pyran-2-one|6-(1-Propenyl)-2H-pyran-2-one|6-(prop-1-enyl)pyran-2-one|Sibirinon|sibirinone

(E)- 6-(1-Propenyl)-2H-pyran-2-one|6-(1-Propenyl)-2H-pyran-2-one|6-(prop-1-enyl)pyran-2-one|Sibirinon|sibirinone

C8H8O2 (136.0524)


   

Ethyl-1,4-benzoquinone

Ethyl-1,4-benzoquinone

C8H8O2 (136.0524)


   

2,3-dihydrobenzofuran-5-ol

2,3-dihydrobenzofuran-5-ol

C8H8O2 (136.0524)


   

2-Hydroxy-6-methylbenzaldehyde

2-Hydroxy-6-methylbenzaldehyde

C8H8O2 (136.0524)


   

2-Methoxytropone

2-Methoxytropone

C8H8O2 (136.0524)


   

Piceol

4-Hydroxyacetophenone (Acetaminophen Impurity E), Pharmaceutical Secondary Standards; Certified Reference Material

C8H8O2 (136.0524)


4-hydroxyacetophenone is a monohydroxyacetophenone carrying a hydroxy substituent at position 4. It has a role as a plant metabolite, a fungal metabolite and a mouse metabolite. 4-Hydroxyacetophenone is a natural product found in Ficus erecta var. beecheyana, Artemisia ordosica, and other organisms with data available. A monohydroxyacetophenone carrying a hydroxy substituent at position 4. 4-Hydroxyacetophenone (P-hydroxyacetophenone) is a key hepatoprotective and choleretic compound in Artemisia capillaris and A. morrisonensis, also has an anti-hepatitis B virus effect and anti-inflammatory effect[1]. 4-Hydroxyacetophenone (P-hydroxyacetophenone) is a key hepatoprotective and choleretic compound in Artemisia capillaris and A. morrisonensis, also has an anti-hepatitis B virus effect and anti-inflammatory effect[1].

   

3-Hydroxyacetophenone

Etilefrine Hydrochloride Imp. E (EP); Etilefrine Imp. E (EP); 1-(3-Hydroxyphenyl)ethanone; 3-Hydroxyacetophenone; Etilefrine Hydrochloride Impurity E; Etilefrine Impurity E

C8H8O2 (136.0524)


3-Hydroxyacetophenone is a natural product found in Vincetoxicum paniculatum, Dianthus caryophyllus, and other organisms with data available. 3-Hydroxyacetophenone (m-Hydroxyacetophenone) is the hydroxy-substituted alkyl phenyl ketone that can be used in synthesis of enantiopure (-)-rivastigmine[1][2]. 3-Hydroxyacetophenone (m-Hydroxyacetophenone) is the hydroxy-substituted alkyl phenyl ketone that can be used in synthesis of enantiopure (-)-rivastigmine[1][2].

   

4-Methoxybenzaldehyde

p-Anisaldehyde, United States Pharmacopeia (USP) Reference Standard

C8H8O2 (136.0524)


4-Methoxybenzaldehyde, also known as 4-anisaldehyde or p-formylanisole, belongs to the class of organic compounds known as benzoyl derivatives, with the chemical formula CH3OC6H4CHO. These are organic compounds containing an acyl moiety of benzoic acid with the formula (C6H5CO-). Anisaldehyde is prepared commercially by oxidation of 4-methoxytoluene (p-cresyl methyl ether) using manganese dioxide to convert a methyl group to the aldehyde group. 4-Methoxybenzaldehyde is a sweet, almond, and anise tasting compound. 4-Methoxybenzaldehyde can be found, on average, in the highest concentration within a few different foods, such as cumins, star anises, and fennels. 4-Methoxybenzaldehyde has also been detected, but not quantified, in several different foods, such as cornmints, anises, herbs and spices, tarragons, and tea. The related ortho isomer has a scent of licorice. It is a colorless liquid with a strong aroma. A solution of para-anisaldehyde in acid and ethanol is a useful stain in thin layer chromatography. Different chemical compounds on the plate can give different colors, allowing easy distinction. It is used as an intermediate in the synthesis of other compounds important in pharmaceuticals and perfumery. P-methoxybenzaldehyde is a member of the class of benzaldehydes consisting of benzaldehyde itself carrying a methoxy substituent at position 4. It has a role as an insect repellent, a human urinary metabolite, a plant metabolite and a bacterial metabolite. 4-Methoxybenzaldehyde is a natural product found in Vanilla pompona, Solidago odora, and other organisms with data available. See also: Anise Oil (part of). Found in anise oil, fennel and vanilla. Flavouring ingredient 4-Methoxybenzaldehyde is a naturally occurring fragrant phenolic compound. 4-Methoxybenzaldehyde has been found in many plant species including horseradish, anise, star anise. 4-Methoxybenzaldehyde is a possible neurotoxicant and it has shown effects that include mortality, attractancy, and interference with host seeking [1]. 4-Methoxybenzaldehyde is a naturally occurring fragrant phenolic compound. 4-Methoxybenzaldehyde has been found in many plant species including horseradish, anise, star anise. 4-Methoxybenzaldehyde is a possible neurotoxicant and it has shown effects that include mortality, attractancy, and interference with host seeking [1].

   

PHENYLACETIC ACID

2-phenylacetic acid

C8H8O2 (136.0524)


A monocarboxylic acid that is toluene in which one of the hydrogens of the methyl group has been replaced by a carboxy group. D009676 - Noxae > D000963 - Antimetabolites D000970 - Antineoplastic Agents

   

2-Hydroxyacetophenone

2-Hydroxyacetophenone

C8H8O2 (136.0524)


   

4-Aminobenzoic acid

4-Aminobenzoic acid

C7H6NO2 (136.0399)


   

p-Anisaldehyde

p-Anisaldehyde

C8H8O2 (136.0524)


   

O-TOLUIC ACID

2-Methylbenzoic acid

C8H8O2 (136.0524)


A methylbenzoic acid that is benzoic acid substituted by a methyl group at position 2. o-Toluic acid (2-Methylbenzoic acid) is a benzoic acid?substituted by a?methyl?group at position 2. O-Toluic acid plays a role as a xenobiotic metabolite.

   

3-Anisaldehyde

Metamethoxybenzaldehyde

C8H8O2 (136.0524)


m-Anisaldehyde is an endogenous metabolite. m-Anisaldehyde is an endogenous metabolite.

   

3-(5-Methyl-2-furyl)prop-2-enal

(e)-2-Methyl-3-(5-methyl-2-furyl)prop-2-enal

C8H8O2 (136.0524)


   

Glycolophenone

Acetophenone, 2'-hydroxy- (8CI)

C8H8O2 (136.0524)


2'-Hydroxyacetophenone is found in alcoholic beverages. 2'-Hydroxyacetophenone is present in tomato, cassia, fried beef, rum, whiskey, cocoa, coffee and black tea. 2'-Hydroxyacetophenone is a flavouring ingredient. Building block in chemical synthesis. 2'-Hydroxyacetophenone is found in alcoholic beverages. 2'-Hydroxyacetophenone is present in tomato, cassia, fried beef, rum, whiskey, cocoa, coffee and black tea. 2'-Hydroxyacetophenone is a flavouring ingredient. Building block in chemical synthesis.

   

FEMA 3697

2-Hydroxy-4-methyl-benzaldehyde

C8H8O2 (136.0524)


2-Hydroxy-4-methylbenzaldehyde is an endogenous metabolite.

   

&beta

3-Buten-2-one, 4-(2-furyl)-, polymers (8ci)

C8H8O2 (136.0524)


   

o-Anisaldehyde

2-Methoxybenzenecarboxaldehyde

C8H8O2 (136.0524)


2-Methoxybenzaldehyde (o-Anisaldehyde), isolated from cinnamon essential oil (CEO), exists antibacterial and antifungal activity[1]. 2-Methoxybenzaldehyde (o-Anisaldehyde), isolated from cinnamon essential oil (CEO), exists antibacterial and antifungal activity[1].

   

Clorius

Methyl benzoate [UN2938] [Keep away from food]

C8H8O2 (136.0524)


   

FEMA 2704

(2E)-3-(furan-2-yl)-2-methylprop-2-enal

C8H8O2 (136.0524)


   

a-Methyl-3-furanacrolein, 8ci

(2Z)-3-(furan-3-yl)-2-methylprop-2-enal

C8H8O2 (136.0524)


   

Methyltrimethoxysilane

Methyltrimethoxysilane

C4H12O3Si (136.0556)


   

8-Fluoroimidazo[1,2-a]pyridine

8-Fluoroimidazo[1,2-a]pyridine

C7H5FN2 (136.0437)


   

DL-Aspartic acid-d3

DL-Aspartic acid-d3

C4H4D3NO4 (136.0563)


   

2-Hydroxy-5-methylbenzaldehyde

2-Hydroxy-5-methylbenzaldehyde

C8H8O2 (136.0524)


   

2,6-dimethyl-p-benzoquinone

2,6-dimethyl-p-benzoquinone

C8H8O2 (136.0524)


   

3-Cyano-4-fluoroaniline

3-Cyano-4-fluoroaniline

C7H5FN2 (136.0437)


   

propyldimethylchlorosilane

propyldimethylchlorosilane

C5H13ClSi (136.0475)


   

(S)-3-Aminopyrrolidin-2-one hydrochloride

(S)-3-Aminopyrrolidin-2-one hydrochloride

C4H9ClN2O (136.0403)


   

6-Fluoro-7-azaindole

6-Fluoro-7-azaindole

C7H5FN2 (136.0437)


   

4-(Aminooxy)butanenitrile hydrochloride (1:1)

4-(Aminooxy)butanenitrile hydrochloride (1:1)

C4H9ClN2O (136.0403)


   

SODIUM CYCLOPENTANE CARBOXYLATE

SODIUM CYCLOPENTANE CARBOXYLATE

C6H9NaO2 (136.05)


   

1H-Benzimidazole,7-fluoro-

1H-Benzimidazole,7-fluoro-

C7H5FN2 (136.0437)


   

Isopropyl Dimethyl Chlorosilane

Isopropyl Dimethyl Chlorosilane

C5H13ClSi (136.0475)


   

Phenylacetic acid-1,2-13C2

Phenylacetic acid-1,2-13C2

C8H8O2 (136.0524)


   

4-Fluoro-1H-indazole

4-Fluoro-1H-indazole

C7H5FN2 (136.0437)


   

2,3-dihydro-1-benzofuran-4-ol

2,3-dihydro-1-benzofuran-4-ol

C8H8O2 (136.0524)


   

6-Fluoroindazole

6-Fluoroindazole

C7H5FN2 (136.0437)


   

5-Cyano-2-fluoro-6-methylpyridine

5-Cyano-2-fluoro-6-methylpyridine

C7H5FN2 (136.0437)


   

5-chloro-2-hydroxy-3-methylbenzaldehyde

5-chloro-2-hydroxy-3-methylbenzaldehyde

C8H8O2 (136.0524)


   

(R)-3-AMINOPYRROLIDIN-2-ONE HYDROCHLORIDE

(R)-3-AMINOPYRROLIDIN-2-ONE HYDROCHLORIDE

C4H9ClN2O (136.0403)


   

3-Aminopyrrolidin-2-one hydrochloride

3-Aminopyrrolidin-2-one hydrochloride

C4H9ClN2O (136.0403)


   

5-Fluor-1H-pyrrolo[2,3-b]pyridin

5-Fluor-1H-pyrrolo[2,3-b]pyridin

C7H5FN2 (136.0437)


   

aminoguanidine carbonate

aminoguanidine carbonate

C2H8N4O3 (136.0596)


   

L-Aspartic acid-d3

L-Aspartic acid-d3

C4H4D3NO4 (136.0563)


   

1H-Benzimidazole,6-fluoro-

1H-Benzimidazole,6-fluoro-

C7H5FN2 (136.0437)


   

5-Fluoro-1H-indazole

5-Fluoro-1H-indazole

C7H5FN2 (136.0437)


   

3-Hydroxy-4-methylbenzaldehyde

3-Hydroxy-4-methylbenzaldehyde

C8H8O2 (136.0524)


   

6,7-Dihydro-4(5H)-benzofuranone

6,7-Dihydro-4(5H)-benzofuranone

C8H8O2 (136.0524)


   

3,4-Methylenedioxytoluene

3,4-Methylenedioxytoluene

C8H8O2 (136.0524)


   

3-Amino-2-fluorobenzonitrile

3-Amino-2-fluorobenzonitrile

C7H5FN2 (136.0437)


   

(2H2)Sulfuric acid - (2H4)hydrazine (1:1)

(2H2)Sulfuric acid - (2H4)hydrazine (1:1)

D6N2O4S (136.0425)


   

6-fluoro-1H-pyrrolo[3,2-c]pyridine

6-fluoro-1H-pyrrolo[3,2-c]pyridine

C7H5FN2 (136.0437)


   

4-AMINOPYRROLIDIN-2-ONE HYDROCHLORIDE

4-AMINOPYRROLIDIN-2-ONE HYDROCHLORIDE

C4H9ClN2O (136.0403)


   

6-Fluoro-1H-pyrrolo[3,2-b]pyridine

6-Fluoro-1H-pyrrolo[3,2-b]pyridine

C7H5FN2 (136.0437)


   

5,6-dihydro-4H-1-benzofuran-7-one

5,6-dihydro-4H-1-benzofuran-7-one

C8H8O2 (136.0524)


   

6-Methylsalicylaldehyde

6-Methylsalicylaldehyde

C8H8O2 (136.0524)


   

2-HYDROXY-5-METHYL-BENZALDEHYDE

2-HYDROXY-5-METHYL-BENZALDEHYDE

C8H8O2 (136.0524)


   

5-fluoro-2-methylpyridine-3-carbonitrile

5-fluoro-2-methylpyridine-3-carbonitrile

C7H5FN2 (136.0437)


   

2-Amino-6-fluorobenzonitrile

2-Amino-6-fluorobenzonitrile

C7H5FN2 (136.0437)


   

ethylene-d4-diamine dihydrochloride

ethylene-d4-diamine dihydrochloride

C2H6Cl2D4N2 (136.0472)


   

(1-Chloroethyl)(trimethyl)silane

(1-Chloroethyl)(trimethyl)silane

C5H13ClSi (136.0475)


   

2,5-Dimethylquinone

2,5-Dimethylquinone

C8H8O2 (136.0524)


   

3-(HYDROXYMETHYL)BENZALDEHYDE

3-(HYDROXYMETHYL)BENZALDEHYDE

C8H8O2 (136.0524)


   

4-Fluoro-7-azaindole

4-Fluoro-7-azaindole

C7H5FN2 (136.0437)


   

5-Amino-3-fluorobenzonitrile

5-Amino-3-fluorobenzonitrile

C7H5FN2 (136.0437)


   

Ethyl Isopropyl Sulfone

Ethyl Isopropyl Sulfone

C5H12O2S (136.0558)


   

3-Hydroxy-5-methylbenzaldehyde

3-Hydroxy-5-methylbenzaldehyde

C8H8O2 (136.0524)


   

4-Amino-2-fluorobenzonitrile

4-Amino-2-fluorobenzonitrile

C7H5FN2 (136.0437)


   

N-(2-Aminoethyl)-2-chloroacetamide

N-(2-Aminoethyl)-2-chloroacetamide

C4H9ClN2O (136.0403)


   

7-Fluoro-1H-indazole

7-Fluoro-1H-indazole

C7H5FN2 (136.0437)


   

2-(hydroxymethyl)benzaldehyde

2-(hydroxymethyl)benzaldehyde

C8H8O2 (136.0524)


   

2,3-Dimethyl-1,4-benzoquinone

2,3-Dimethyl-1,4-benzoquinone

C8H8O2 (136.0524)


   

1H-Indazole, 3-fluoro-

1H-Indazole, 3-fluoro-

C7H5FN2 (136.0437)


   

7-Fluoro-1H-pyrrolo[3,2-c]pyridine

7-Fluoro-1H-pyrrolo[3,2-c]pyridine

C7H5FN2 (136.0437)


   

2,3-DIHYDROBENZOFURAN-6-OL

2,3-DIHYDROBENZOFURAN-6-OL

C8H8O2 (136.0524)


   

1,4-Benzodioxan

1,4-Benzodioxane

C8H8O2 (136.0524)


   

bis(dimethylphosphino)methane

bis(dimethylphosphino)methane

C5H14P2 (136.0571)


   

2-Amino-5-fluorobenzonitrile

2-Amino-5-fluorobenzonitrile

C7H5FN2 (136.0437)


   

6-fluoroimidazo[1,2-a]pyridine

6-fluoroimidazo[1,2-a]pyridine

C7H5FN2 (136.0437)


   

4-Hydroxymethylbenzaldehyde

4-Hydroxymethylbenzaldehyde

C8H8O2 (136.0524)


   

3-ethylsulfanylpropane-1,2-diol

3-ethylsulfanylpropane-1,2-diol

C5H12O2S (136.0558)


   

spiro[3.4]oct-6-ene-1,3-dione

spiro[3.4]oct-6-ene-1,3-dione

C8H8O2 (136.0524)


   

2-(6-fluoropyridin-2-yl)acetonitrile

2-(6-fluoropyridin-2-yl)acetonitrile

C7H5FN2 (136.0437)


   

Aminoguanidine bicarbonate

Aminoguanidine bicarbonate

C2H8N4O3 (136.0596)


   

2-Hydroxy-3-methylbenzaldehyde

2-Hydroxy-3-methylbenzaldehyde

C8H8O2 (136.0524)


   

N-HYDROXYCYCLOPROPANECARBOXIMIDAMIDE HYDROCHLORIDE

N-HYDROXYCYCLOPROPANECARBOXIMIDAMIDE HYDROCHLORIDE

C4H9ClN2O (136.0403)


   

2-(2-methoxyethoxy)ethanethiol

2-(2-methoxyethoxy)ethanethiol

C5H12O2S (136.0558)


   

1,3-DIHYDROISOBENZOFURAN-1-OL

1,3-DIHYDROISOBENZOFURAN-1-OL

C8H8O2 (136.0524)


   

alpha-Methoxytropone

alpha-Methoxytropone

C8H8O2 (136.0524)


   

5-hydroxy-2-methylbenzaldehyde

5-hydroxy-2-methylbenzaldehyde

C8H8O2 (136.0524)


   

1H-1,2,3-Triazolo[4,5-d]pyrimidin-5-amine (9CI)

1H-1,2,3-Triazolo[4,5-d]pyrimidin-5-amine (9CI)

C4H4N6 (136.0497)


   

Azetidine-3-carboxamide

Azetidine-3-carboxamide

C4H9ClN2O (136.0403)


   

2-Fluoro-6-methylnicotinonitrile

2-Fluoro-6-methylnicotinonitrile

C7H5FN2 (136.0437)


   

(Chloromethyl)(ethyl)dimethylsilane

(Chloromethyl)(ethyl)dimethylsilane

C5H13ClSi (136.0475)


   

5-amino-2-fluorobenzonitrile

5-amino-2-fluorobenzonitrile

C7H5FN2 (136.0437)


   

1,1-Dimethoxy-2-(methylthio)ethane

1,1-Dimethoxy-2-(methylthio)ethane

C5H12O2S (136.0558)


   

8-Azaadenine

8-Azaadenine

C4H4N6 (136.0497)


A triazolopyrimidine that is [1,2,3]triazolo[4,5-d]pyrimidine bearing an amino substituent at position 7.

   

2-(trimethylsilyl)ethyl chloride

2-(trimethylsilyl)ethyl chloride

C5H13ClSi (136.0475)


   

5-Cyano-2-fluoro-3-picoline

5-Cyano-2-fluoro-3-picoline

C7H5FN2 (136.0437)


   

Acetaldehyde,2-phenoxy-

Acetaldehyde,2-phenoxy-

C8H8O2 (136.0524)


   

2-fluoro-1H-benzimidazole

2-fluoro-1H-benzimidazole

C7H5FN2 (136.0437)


   

2-Amino-4-fluorobenzonitrile

2-Amino-4-fluorobenzonitrile

C7H5FN2 (136.0437)


   

5-Fluoro-1H-pyrrolo[2,3-b]pyridine

5-Fluoro-1H-pyrrolo[2,3-b]pyridine

C7H5FN2 (136.0437)


   

3-Fluoro-4-aminobenzonitrile

3-Fluoro-4-aminobenzonitrile

C7H5FN2 (136.0437)


   

3-Amino-4-fluorobenzonitrile

3-Amino-4-fluorobenzonitrile

C7H5FN2 (136.0437)


   

3-hydroxy-2-methylbenzaldehyde

3-hydroxy-2-methylbenzaldehyde

C8H8O2 (136.0524)


   

1-Amino-2-pyrrolidinone hydrochloride (1:1)

1-Amino-2-pyrrolidinone hydrochloride (1:1)

C4H9ClN2O (136.0403)


   

Phenylacetic acid-2-13C

Phenylacetic acid-2-13C

C8H8O2 (136.0524)


   

Anthranilate

Anthranilate

C7H6NO2- (136.0399)


An aminobenzoate that is the conjugate base of anthranilic acid, obtained by deprotonation of the carboxy group. D002491 - Central Nervous System Agents > D000927 - Anticonvulsants COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

   

3-Aminobenzoate

3-Aminobenzoate

C7H6NO2- (136.0399)


   

3-[(2-Hydroxyethyl)thio]-1-propanol

3-[(2-Hydroxyethyl)thio]-1-propanol

C5H12O2S (136.0558)


An aliphatic sulfide that is propan-1-ol substituted by a (2-hydroxyethyl)thio group at position 3.

   

furfural acetone

4-(2-Furanyl)-3-buten-2-one

C8H8O2 (136.0524)


   

Formic acid, 4-methylphenyl ester

Formic acid, 4-methylphenyl ester

C8H8O2 (136.0524)


   

Cyclopenta[b]pyran-4(5H)-one, 6,7-dihydro-

Cyclopenta[b]pyran-4(5H)-one, 6,7-dihydro-

C8H8O2 (136.0524)


   

AI3-14650

InChI=1\C8H8O2\c1-6(9)7-3-2-4-8(10)5-7\h2-5,10H,1H

C8H8O2 (136.0524)


3-Hydroxyacetophenone (m-Hydroxyacetophenone) is the hydroxy-substituted alkyl phenyl ketone that can be used in synthesis of enantiopure (-)-rivastigmine[1][2]. 3-Hydroxyacetophenone (m-Hydroxyacetophenone) is the hydroxy-substituted alkyl phenyl ketone that can be used in synthesis of enantiopure (-)-rivastigmine[1][2].

   

Obepin

InChI=1\C8H8O2\c1-10-8-4-2-7(6-9)3-5-8\h2-6H,1H

C8H8O2 (136.0524)


4-Methoxybenzaldehyde is a naturally occurring fragrant phenolic compound. 4-Methoxybenzaldehyde has been found in many plant species including horseradish, anise, star anise. 4-Methoxybenzaldehyde is a possible neurotoxicant and it has shown effects that include mortality, attractancy, and interference with host seeking [1]. 4-Methoxybenzaldehyde is a naturally occurring fragrant phenolic compound. 4-Methoxybenzaldehyde has been found in many plant species including horseradish, anise, star anise. 4-Methoxybenzaldehyde is a possible neurotoxicant and it has shown effects that include mortality, attractancy, and interference with host seeking [1].

   

AI3-01375

InChI=1\C8H8O2\c1-10-8-5-3-2-4-7(8)6-9\h2-6H,1H

C8H8O2 (136.0524)


2-Methoxybenzaldehyde (o-Anisaldehyde), isolated from cinnamon essential oil (CEO), exists antibacterial and antifungal activity[1]. 2-Methoxybenzaldehyde (o-Anisaldehyde), isolated from cinnamon essential oil (CEO), exists antibacterial and antifungal activity[1].

   

AI3-08920

InChI=1\C8H8O2\c9-8(10)6-7-4-2-1-3-5-7\h1-5H,6H2,(H,9,10

C8H8O2 (136.0524)


D009676 - Noxae > D000963 - Antimetabolites D000970 - Antineoplastic Agents

   

AI3-12134

InChI=1\C8H8O2\c1-6(9)7-4-2-3-5-8(7)10\h2-5,10H,1H

C8H8O2 (136.0524)


2'-Hydroxyacetophenone is found in alcoholic beverages. 2'-Hydroxyacetophenone is present in tomato, cassia, fried beef, rum, whiskey, cocoa, coffee and black tea. 2'-Hydroxyacetophenone is a flavouring ingredient. Building block in chemical synthesis. 2'-Hydroxyacetophenone is found in alcoholic beverages. 2'-Hydroxyacetophenone is present in tomato, cassia, fried beef, rum, whiskey, cocoa, coffee and black tea. 2'-Hydroxyacetophenone is a flavouring ingredient. Building block in chemical synthesis.

   

99-94-5

InChI=1\C8H8O2\c1-6-2-4-7(5-3-6)8(9)10\h2-5H,1H3,(H,9,10

C8H8O2 (136.0524)


p-Toluic acid (4-Methylbenzoic acid) is a substituted?benzoic acid?and can be used as an intermediate for the synthesis of para-aminomethylbenzoic acid (PAMBA), p-tolunitrile, etc. p-Toluic acid (4-Methylbenzoic acid) is a substituted?benzoic acid?and can be used as an intermediate for the synthesis of para-aminomethylbenzoic acid (PAMBA), p-tolunitrile, etc.

   

c0276

Acetophenone, 2-hydroxy- (8CI)

C8H8O2 (136.0524)


2-Hydroxyacetophenone is a principal root volatile of the Carissa edulis[1]. 2-Hydroxyacetophenone shows inhibitory effects on infection of HIV/SARS-CoV S pseudovirus with an IC50 of 1.8 mM[2]. 2-Hydroxyacetophenone is a principal root volatile of the Carissa edulis[1]. 2-Hydroxyacetophenone shows inhibitory effects on infection of HIV/SARS-CoV S pseudovirus with an IC50 of 1.8 mM[2].

   

AI3-52556

InChI=1\C8H8O2\c1-10-8-4-2-3-7(5-8)6-9\h2-6H,1H

C8H8O2 (136.0524)


m-Anisaldehyde is an endogenous metabolite. m-Anisaldehyde is an endogenous metabolite.

   

4-Hydroxyacetophenone

4-Hydroxyacetophenone

C8H8O2 (136.0524)


4-hydroxyacetophenone, also known as (4-hydroxyphenyl)ethan-1-one or 4-acetylphenol, is a member of the class of compounds known as alkyl-phenylketones. Alkyl-phenylketones are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group. 4-hydroxyacetophenone is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). 4-hydroxyacetophenone is a mild, sweet, and balsam tasting compound found in sweet orange, which makes 4-hydroxyacetophenone a potential biomarker for the consumption of this food product. 4-Hydroxyacetophenone (P-hydroxyacetophenone) is a key hepatoprotective and choleretic compound in Artemisia capillaris and A. morrisonensis, also has an anti-hepatitis B virus effect and anti-inflammatory effect[1]. 4-Hydroxyacetophenone (P-hydroxyacetophenone) is a key hepatoprotective and choleretic compound in Artemisia capillaris and A. morrisonensis, also has an anti-hepatitis B virus effect and anti-inflammatory effect[1].

   

(4-Hydroxyphenyl)acetaldehyde

2-(4-Hydroxyphenyl)acetaldehyde

C8H8O2 (136.0524)


4-hydroxyphenylacetaldehyde, also known as poh-ph-ch2cho or hpal, is a member of the class of compounds known as phenylacetaldehydes. Phenylacetaldehydes are compounds containing a phenylacetaldehyde moiety, which consists of a phenyl group substituted at the second position by an acetalydehyde. 4-hydroxyphenylacetaldehyde is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). 4-hydroxyphenylacetaldehyde can be found in a number of food items such as daikon radish, mixed nuts, alaska blueberry, and japanese chestnut, which makes 4-hydroxyphenylacetaldehyde a potential biomarker for the consumption of these food products. 4-hydroxyphenylacetaldehyde exists in all living species, ranging from bacteria to humans.

   

3-Pyridylacetate

3-Pyridylacetate

C7H6NO2- (136.0399)


   

6-Methylnicotinate

6-Methylnicotinate

C7H6NO2- (136.0399)


   

5-Methyl-picolinate

5-Methyl-picolinate

C7H6NO2- (136.0399)


   
   

Allyl 2-furyl ketone

Allyl 2-furyl ketone

C8H8O2 (136.0524)


   

4-Methylbenzoic acid (alpha-13C)

4-Methylbenzoic acid (alpha-13C)

C8H8O2 (136.0524)


   

Phenyl acetate

PHENYL ACETATE

C8H8O2 (136.0524)


Phenyl acetate is an endogenous metabolite. Phenyl acetate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=122-79-2 (retrieved 2024-08-21) (CAS RN: 122-79-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

   

Benzyl formate

Benzyl formate

C8H8O2 (136.0524)


   

4-Methylbenzoic acid

4-Methylbenzoic acid

C8H8O2 (136.0524)


p-Toluic acid (4-Methylbenzoic acid) is a substituted?benzoic acid?and can be used as an intermediate for the synthesis of para-aminomethylbenzoic acid (PAMBA), p-tolunitrile, etc. p-Toluic acid (4-Methylbenzoic acid) is a substituted?benzoic acid?and can be used as an intermediate for the synthesis of para-aminomethylbenzoic acid (PAMBA), p-tolunitrile, etc.

   

M-toluic Acid

3-Methylbenzoic acid

C8H8O2 (136.0524)


A methylbenzoic acid carrying a methyl substituent at position 3.

   

4-Hydroxyphenylacetaldehyde

2-(4-Hydroxyphenyl)acetaldehyde

C8H8O2 (136.0524)


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3,4-Dihydroxystyrene

4-Vinylbenzene-1,2-diol

C8H8O2 (136.0524)


   

4-Aminobenzoate

4-Aminobenzoate

C7H6NO2- (136.0399)


An aromatic amino-acid anion that is the conjugate base of 4-aminobenzoic acid.

   

2-Hydroxy-4-methylbenzaldehyde

2-Hydroxy-4-methylbenzaldehyde

C8H8O2 (136.0524)


2-Hydroxy-4-methylbenzaldehyde is an endogenous metabolite.

   

2-methyl-3-(2-furyl)propenal

2-methyl-3-(2-furyl)propenal

C8H8O2 (136.0524)


   

3-(3-Furanyl)-2-methyl-2-propenal

3-(3-Furanyl)-2-methyl-2-propenal

C8H8O2 (136.0524)


   

p-methoxybenzaldehyde

p-methoxybenzaldehyde

C8H8O2 (136.0524)


A member of the class of benzaldehydes consisting of benzaldehyde itself carrying a methoxy substituent at position 4.

   

Dihydroxystyrene

Dihydroxystyrene

C8H8O2 (136.0524)


   

Hydroxyphenylacetaldehyde

Hydroxyphenylacetaldehyde

C8H8O2 (136.0524)


   

Methylbenzoic acid

Methylbenzoic acid

C8H8O2 (136.0524)


   

6-[(1e)-prop-1-en-1-yl]pyran-2-one

6-[(1e)-prop-1-en-1-yl]pyran-2-one

C8H8O2 (136.0524)


   

4-ethenylbenzene-1,3-diol

4-ethenylbenzene-1,3-diol

C8H8O2 (136.0524)


   

6-(prop-1-en-1-yl)pyran-2-one

6-(prop-1-en-1-yl)pyran-2-one

C8H8O2 (136.0524)


   

2,5-dimethylcyclohexa-2,5-diene-1,4-dione

2,5-dimethylcyclohexa-2,5-diene-1,4-dione

C8H8O2 (136.0524)


   

(1z)-1-phenylethene-1,2-diol

(1z)-1-phenylethene-1,2-diol

C8H8O2 (136.0524)


   

2,3-dihydro-1-benzofuran-5-ol

2,3-dihydro-1-benzofuran-5-ol

C8H8O2 (136.0524)