Exact Mass: 108.0575118

Exact Mass Matches: 108.0575118

Found 233 metabolites which its exact mass value is equals to given mass value 108.0575118, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

p-Phenylenediamine

4-Phenylenediamine monohydrochloride

C6H8N2 (108.06874479999999)


D004396 - Coloring Agents

   

m-Phenylenediamine

Meta-phenylenediamine

C6H8N2 (108.06874479999999)


KEIO_ID P035

   

p-Cresol

4-(Pentafluorosulfanyl)phenol

C7H8O (108.0575118)


para-Cresol, also 4-methylphenol, is an organic compound with the formula CH3C6H4(OH). P-cresol is a cresol that consists of toluene substituted by a hydroxy group at position 4. It is a metabolite of aromatic amino acid metabolism produced by intestinal microflora in humans and animals. It has a role as a uremic toxin, a human metabolite and an Escherichia coli metabolite. It is a colourless solid that is widely used intermediate in the production of other chemicals. It is a derivative of phenol and is an isomer of o-cresol and m-cresol. It is a partially lipophilic moiety which strongly binds to plasma protein (close to 100\\%) under normal conditions. p-Cresol is metabolized through conjugation, mainly sulphation and glucuronization, but removal of the unconjugated p-cresol is, at least in part, via the urine. Therefore it is not surprising that this compound, together with several other phenoles, is retained when the kidneys fail. P-Cresol is an end-product of protein breakdown, and an increase of the nutritional protein load in healthy individuals results in enhanced generation and urinary excretion. The serum p-cresol concentration in uremic patients can be decreased by changing to a low-protein diet. p-Cresol is one of the metabolites of the amino acid tyrosine, and to a certain extent also of phenylalanine, which are converted to 4-hydroxyphenylacetic acid by intestinal bacteria, before being decarboxylated to p-cresol (putrefaction). The main contributing bacteria are aerobes (mainly enterobacteria), but to a certain extent also anaerobes play a role (mainly Clostridium perfringens). In uremia, modifications in the intestinal flora result in the specific overgrowth of bacteria that are specific p-cresol producers. The administration of antibiotics reduces urinary excretion of p-cresol, as a result of the liquidation of the producing bacteria. Environmental factors might also contribute. The liver cytochrome P450 metabolizes toluene to benzyl alcohol, but also to o-cresol and p-cresol. Toluene is not only used industrially, but it is also the most widely abusively inhaled solvent. Furthermore, p-cresol is a metabolite of menthofuran, one of the metabolites of R-(+)-pulegone, which is found in extracts from the plants Mentha pulegium and Hedeoma pulegioides, commonly known as pennyroyal oil and pennyroyal tea. These extracts are popular as unconventional herbal therapeutic agents and are applied as abortiva, diaphoretics, emmenagogues, and psychedelic drugs. Pennyroyal oil is extensively used for its pleasant mint-like smell in the flavoring industry. The toxicity of pennyroyal oil and menthofuran is well known. Another compound used in traditional medicine, especially in Japan, which is a precursor of p-cresol is wood tar creosote. p-Cresol has been reported to affect several biochemical, biological and physiological functions: (i) it diminishes the oxygen uptake of rat cerebral cortex slices; (ii) it increases the free active drug concentration of warfarin and diazepam; (iii) it has been related to growth retardation in the weanling pig; (iv) it alters cell membrane permeability, at least in bacteria; (v) it induces LDH leakage from rat liver slices; (vi) it induces susceptibility to auditive epileptic crises; and (vii) it blocks cell K+ channels. (PMID:10570076). p-Cresol is a uremic toxin that is at least partially removed by peritoneal dialysis in haemodialysis patients, and has been involved in the progression of renal failure (PMID:11169029). At concentrations encountered during uremia, p-cresol inhibits phagocyte function and decreases leukocyte adhesion to cytokine-stimulated endothelial cells. (PMID:14681860). p-Cresol can be found in Bacteroides, Bifidobacterium, Clostridium, Enterobacter and Lactobacillus (PMID:2394806; PMID:30208103). As a volatile organic compound, it has been identified as a fecal biomarker of Clostridium difficile infection (PMID:30986230). Present in blackcurrant buds, asparagus, cooked cured pork, black tea, fermented tea, yellow passion fruit juice, malt, peated malt, kumazasa (Sasa albo-marginata), lambs lettuce, squid and cuttlefish. Flavouring ingredient. 4-Methylphenol is found in many foods, some of which are animal foods, cereals and cereal products, tamarind, and tarragon.

   

Quinone

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

C6H4O2 (108.0211284)


Quinone is also called 1,4-benzoquinone or cyclohexadienedione. Quinones are oxidized derivatives of aromatic compounds and are often readily made from reactive aromatic compounds with electron-donating substituents such as phenols and catechols, which increase the nucleophilicity of the ring and contributes to the large redox potential needed to break aromaticity. Derivatives of quinones are common constituents of biologically relevant molecules. Some serve as electron acceptors in electron transport chains such as those in photosynthesis (plastoquinone, phylloquinone), and aerobic respiration (ubiquinone). Quinone is a common constituent of biologically relevant molecules (e.g. Vitamin K1 is phylloquinone). A natural example of quinones as oxidizing agents is the spray of bombardier beetles. Hydroquinone is reacted with hydrogen peroxide to produce a fiery blast of steam, a strong deterent in the animal world. 1,4-Benzoquinone, commonly known as para-quinone or quinone, is a chemical compound with the formula C6H4O2. 1,4-Benzoquinone is found in barley, olive, and anise. D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents

   

Phenylhydrazine

Phenylhydrazine monohydrochloride

C6H8N2 (108.06874479999999)


Phenylhydrazine, also known as hydrazinobenzene or phenyldiazane, is a member of the class of compounds known as phenylhydrazines. Phenylhydrazines are compounds containing a phenylhydrazide moiety, which consists of a hydrazide substituent attached to a phenyl group. Phenylhydrazine is soluble (in water) and a very strong basic compound (based on its pKa). Phenylhydrazine can be found in sweet bay, which makes phenylhydrazine a potential biomarker for the consumption of this food product. Phenylhydrazine is the chemical compound with the formula C6H5NHNH2. It is often abbreviated as PhNHNH2 . D009676 - Noxae > D016877 - Oxidants

   

m-Cresol

3-Cresol, calcium salt(1:2)

C7H8O (108.0575118)


m-Cresol is an isomer of p-cresol and o-cresol. Cresols are organic compounds which are methylphenols. They are a widely occurring natural and manufactured group of aromatic organic compounds which are categorized as phenols (sometimes called phenolics). Depending on the temperature, cresols can be solid or liquid because they have melting points not far from room temperature. Like other types of phenols, they are slowly oxidized by long exposure to air and the impurities often give cresols a yellowish to brownish red tint. Cresols have an odor characteristic to that of other simple phenols, reminiscent to some of a "medicine" smell. Cresol solutions are used as household cleaners and disinfectants, perhaps most famously under the trade name Lysol. In the past, cresol solutions have been used as antiseptics in surgery, but they have been largely displaced in this role by less toxic compounds. Lysol was also advertised as a disinfecting vaginal douche in mid-twentieth century America. Cresols are found in many foods and in wood and tobacco smoke, crude oil, coal tar, and in brown mixtures such as creosote and cresylic acids, which are wood preservatives. Small organisms in soil and water produce cresols when they break down materials in the environment. Most exposures to cresols are at very low levels that are not harmful. When cresols are breathed, ingested, or applied to the skin at very high levels, they can be very harmful. Effects observed in people include irritation and burning of skin, eyes, mouth, and throat; abdominal pain and vomiting; heart damage; anemia; liver and kidney damage; facial paralysis; coma; and death. Breathing high levels of cresols for a short time results in irritation of the nose and throat. Aside from these effects, very little is known about the effects of breathing cresols, for example, at lower levels over longer times. Ingesting high levels results in kidney problems, mouth and throat burns, abdominal pain, vomiting, and effects on the blood and nervous system. Skin contact with high levels of cresols can burn the skin and damage the kidneys, liver, blood, brain, and lungs. m-Cresol is a microbial metabolite that can be found in Lysinibacillus. Flavouring ingredient. 3-Methylphenol is found in asparagus, tea, and arabica coffee.

   

Benzyl alcohol

Hydroxymethylpolystyrene resin

C7H8O (108.0575118)


Benzyl alcohol is a colorless liquid with a sharp burning taste and slight odor. It is used as a local anesthetic and to reduce pain associated with Lidocaine injection. Also, it is used in the manufacture of other benzyl compounds, as a pharmaceutical aid, and in perfumery and flavoring. Benzyl Alcohol is an aromatic alcohol used in a wide variety of cosmetic formulations as a fragrance component, preservative, solvent, and viscosity-decreasing agent. Benzyl alcohol is metabolized to Benzoic Acid, which reacts with glycine and excreted as hippuric acid in the human body. Acceptable daily intakes were established by the World Health Organization at 5 mg/kg for Benzyl alcohol. No adverse effects of benzyl alcohol have been seen in chronic exposure animal studies using rats and mice. Effects of Benzyl Alcohol in chronic exposure animal studies are limited to reduced feed intake and reduced growth. Some differences have been noted in one reproductive toxicity study using mice, but these were limited to lower maternal body weights and decreased mean litter weights. Another study also noted that fetal weight was decreased compared to controls, but a third study showed no differences between control and benzyl alcohol-treated groups. Benzyl alcohol has been associated with an increased number of resorptions and malformations in hamsters, but there have been no reproductive or developmental toxicity findings in studies using mice and rats. Genotoxicity tests for benzyl alcohol are mostly negative, but there were some assays that were positive. Carcinogenicity studies, however, were negative. Clinical data indicates that benzyl alcohol can produce nonimmunologic contact urticaria and nonimmunologic immediate contact reactions, characterized by the appearance of wheals, erythema, and pruritis. 5\\\\% benzyl alcohol can elicit a reaction. Benzyl alcohol is not a sensitizer at 10\\\\%. Benzyl alcohol could be used safely at concentrations up to 5\\\\%, but that manufacturers should consider the nonimmunologic phenomena when using benzyl alcohol in cosmetic formulations designed for infants and children. Additionally, Benzyl alcohol is considered safe up to 10\\\\% for use in hair dyes. The limited body exposure, the duration of use, and the frequency of use are considered in concluding that the nonimmunologic reactions would not be a concern. Because of the wide variety of product types in which benzyl alcohol may be used, it is likely that inhalation may be a route of exposure. The available safety tests are not considered sufficient to support the safety of benzyl alcohol in formulations where inhalation is a route of exposure. Inhalation toxicity data are needed to complete the safety assessment of benzyl alcohol where inhalation can occur. (PMID:11766131). Constituent of jasmine and other ethereal oils, both free and as estersand is also present in cherry, orange juice, mandarin peel oil, guava fruit, feijoa fruit, pineapple, leek, cinnamon, cloves, mustard, fermented tea, basil and red sage. Flavouring ingredient P - Antiparasitic products, insecticides and repellents > P03 - Ectoparasiticides, incl. scabicides, insecticides and repellents > P03A - Ectoparasiticides, incl. scabicides D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D000777 - Anesthetics D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents C254 - Anti-Infective Agent > C28394 - Topical Anti-Infective Agent COVID info from PDB, Protein Data Bank Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS Benzyl alcohol is an aromatic alcohol, a colorless liquid with a mild aromatic odor. Benzyl alcohol is an aromatic alcohol, a colorless liquid with a mild aromatic odor.

   

o-Phenylenediamine

1,2-Diaminobenzene dihydrochloride

C6H8N2 (108.06874479999999)


   

Anisole

Methoxy-benzene (anisol)

C7H8O (108.0575118)


Anisole is a flavouring agent Anisole is a precursor to perfumes, insect pheromones, and pharmaceuticals. For example, synthetic anethole is prepared from anisole. Anisole undergoes electrophilic aromatic substitution reaction more quickly than does benzene, which in turn reacts more quickly than nitrobenzene. The methoxy group is an ortho/para directing group, which means that electrophilic substitution preferentially occurs at these three sites. The enhanced nucleophilicity of anisole vs benzene reflects the influence of the methoxy group, which renders the ring more electron-rich. The methoxy group strongly affects the pi cloud of the ring, moreso than the inductive effect of the electronegative oxygen. Flavouring agent

   

o-Cresol

2-Hydroxy-1-methylbenzene

C7H8O (108.0575118)


o-Cresol is a minor urinary metabolite of toluene, O-cresol is a cresol that is phenol substituted by a methyl group at position 2. It is a minor urinary metabolite of toluene. It has a role as a human xenobiotic metabolite. It is widely used chemical with neurotoxicological properties (PMID:15687000). o-Cresol is used commercially as a disinfectant. Exposure may occur by inhalation, by cutaneous adsorption or by oral ingestion. o-Cresol denature and precipitate cellular proteins and thus may rapidly cause poisoning. o-Cresol is metabolized by conjugation and oxidation. Ingestion of o-Cresol cause intense burning of mouth and throat, followed by marked abdominal pain and distress. The minimum lethal dose of cresol by mouth is about 2 g (PMID 15040915). o-Cresol is a microbial metabolite that can be found in Pseudomonas. Besides, o-Cresol is one of the chemical compounds found in castoreum. This compound is gathered from the beavers castor glands and found in the white cedar consumed by the beavers. Together with many other compounds, o-cresol is traditionally extracted from coal tar, the volatile materials obtained in the production of coke from coal. A similar source material is petroleum residues. These residue contains a few percent by weight of phenol and isomeric cresols. In addition to the materials derived from these natural sources, about two thirds of the Western worlds supply is produced by methylation of phenol using methanol. Flavouring ingredient. 2-Methylphenol is found in many foods, some of which are yellow bell pepper, pepper (c. annuum), arabica coffee, and asparagus.

   

1,2-Benzoquinone

3,5-Cyclohexadiene-1,2-dione (9ci)

C6H4O2 (108.0211284)


1,2-Benzoquinone is a reactive electrophile that is an intermediate in benzene metabolism. It is substrate for the enzyme Catechol oxidase (EC 1.10.3.1) and can be generated from the oxidation of catechol. 1,2-Benzoquinone is capable of reacting with blood proteins to produce adducts. 1,2-Benzoquinone, also called ortho-benzoquinone or cyclohexa-3,5-diene-1,2-dione, is a ketone, with formula C6H4O2. It is one of the two isomers of quinone, the other being 1,4-benzoquinone. O-Quinone is found in tea.

   

4-Vinylcyclohexene

4-Ethenyl-1-cyclohexene

C8H12 (108.09389519999999)


   

2-Picolylamine

2-Pyridinemethanamine

C6H8N2 (108.06874479999999)


   

2,6-Dimethylpyrazine

2,6-Dimethyl-1,4-diazine

C6H8N2 (108.06874479999999)


2,6-Dimethylpyrazine, also known as fema 3273 or 2,5-DMP, belongs to the class of organic compounds known as pyrazines. Pyrazines are compounds containing a pyrazine ring, which is a six-member aromatic heterocycle, that consists of two nitrogen atoms (at positions 1 and 4) and four carbon atoms. Alkylpyrazines are chemical compounds based on pyrazine with different substitution patterns. 2,6-Dimethylpyrazine is a cocoa, roastbeef, and roastednut tasting compound. 2,6-Dimethylpyrazine has been detected, but not quantified, in tea. This could make 2,6-dimethylpyrazine a potential biomarker for the consumption of these foods. Alkylpyrazines are also formed during the cooking of some foods via Maillard reactions. It occurs naturally in asparagus, black or green tea, crispbread, malt, raw shrimp, soya, squid, Swiss cheeses, and wheat bread. It occurs naturally in baked potato, black or green tea, crispbread, French fries, malt, peated malt, raw asparagus, roasted barley, roasted filberts or pecans, squid, wheat bread, wild rice (Zizania aquatica), and wort. 2,6-dimethylpyrazine, also known as 2,5-dmp, is a member of the class of compounds known as pyrazines. Pyrazines are compounds containing a pyrazine ring, which is a six-member aromatic heterocycle, that consists of two nitrogen atoms (at positions 1 and 4) and four carbon atoms. 2,6-dimethylpyrazine is soluble (in water) and a moderately basic compound (based on its pKa). 2,6-dimethylpyrazine is a cocoa, coffee, and roast beef tasting compound and can be found in a number of food items such as tea, mollusks, kohlrabi, and potato, which makes 2,6-dimethylpyrazine a potential biomarker for the consumption of these food products. 2,6-dimethylpyrazine can be found primarily in feces. 2,6-dimethylpyrazine exists in all eukaryotes, ranging from yeast to humans. 2,6-Dimethylpyrazine is a key aroma compound in Boletus edulis[1]. 2,6-Dimethylpyrazine is a key aroma compound in Boletus edulis[1].

   

2,5-Dimethylpyrazine

2,5-Dimethyl-1,4-diazine

C6H8N2 (108.06874479999999)


2,5-Dimethylpyrazine, also known as fema 3272 or pyrazine,2,5-dimethyl, belongs to the class of organic compounds known as pyrazines. Pyrazines are compounds containing a pyrazine ring, which is a six-member aromatic heterocycle, that consists of two nitrogen atoms (at positions 1 and 4) and four carbon atoms. 2,5-Dimethylpyrazine is a cocoa, grass, and medicinal tasting compound. 2,5-Dimethylpyrazine is found, on average, in the highest concentration within kohlrabis. 2,5-Dimethylpyrazine has also been detected, but not quantified, in several different foods, such as green vegetables, soy beans, asparagus, tortilla chips, and fenugreeks. This could make 2,5-dimethylpyrazine a potential biomarker for the consumption of these foods. It occurs naturally in baked potato, black or green tea, crispbread, French fries, malt, peated malt, raw asparagus, roasted barley, roasted filberts or pecans, squid, wheat bread, wild rice (Zizania aquatica), and wort. Alkylpyrazines are chemical compounds based on pyrazine with different substitution patterns. Some alkylpyrazines are naturally occurring highly aromatic substances which often have a very low odor threshold and contribute to the taste and aroma of various foods including coffee and wines. Alkylpyrazines are also formed during the cooking of some foods via Maillard reactions. 2,5-Dimethylpyrazine is used as flavouring additive and odorant in foods. It is found in asparagus, wheat bread, crispbread, swiss cheeses, black or green tea, soya, malt, raw shrimp and squid. 2,5-Dimethylpyrazine is an endogenous metabolite. 2,5-Dimethylpyrazine is an endogenous metabolite.

   

2,3-Dimethylpyrazine

2,3-Dimethyl-1,4-diazine

C6H8N2 (108.06874479999999)


2,3-Dimethylpyrazine, also known as fema 3271, belongs to the class of organic compounds known as pyrazines. Pyrazines are compounds containing a pyrazine ring, which is a six-member aromatic heterocycle, that consists of two nitrogen atoms (at positions 1 and 4) and four carbon atoms. Some alkylpyrazines are naturally occurring highly aromatic substances which often have a very low odor threshold and contribute to the taste and aroma of various foods including coffee and wines. 2,3-Dimethylpyrazine is an almond, butter, and caramel tasting compound. 2,3-Dimethylpyrazine has been detected, but not quantified, in several different foods, such as asparagus, fruits, red bell peppers, orange bell peppers, and green bell peppers. This could make 2,3-dimethylpyrazine a potential biomarker for the consumption of these foods. It occurs naturally in asparagus, black or green tea, crispbread, malt, raw shrimp, soya, squid, Swiss cheeses, and wheat bread. It occurs naturally in baked potato, black or green tea, crispbread, French fries, malt, peated malt, raw asparagus, roasted barley, roasted filberts or pecans, squid, wheat bread, wild rice (Zizania aquatica), and wort. 2,3-Dimethylpyrazine 2,3-Dimethylpyrazine is a component of the aroma of roasted sesame seeds. Alkylpyrazines are also formed during the cooking of some foods via Maillard reactions. Alkylpyrazines are chemical compounds based on pyrazine with different substitution patterns. Flavour additive and odorant in foods, Present in papaya, crispbread, Swiss cheeses, black or green tea, asparagus, kohlrabi, baked potato, French fries, bell pepper, roasted filberts or pecans, roasted barley and other foodstuffs. 2,3-Dimethylpyrazine is found in many foods, some of which are green bell pepper, red bell pepper, potato, and fruits.

   

2-Ethylpyrazine

2-Ethyl-1,4-diazine

C6H8N2 (108.06874479999999)


2-Ethylpyrazine, also known as fema 3281 or moldin, belongs to the class of organic compounds known as pyrazines. Pyrazines are compounds containing a pyrazine ring, which is a six-member aromatic heterocycle, that consists of two nitrogen atoms (at positions 1 and 4) and four carbon atoms. 2-Ethylpyrazine is a bitter, cocoa, and musty tasting compound. 2-Ethylpyrazine has been detected, but not quantified, in several different foods, such as asparagus, pulses, cocoa and cocoa products, cereals and cereal products, and tortilla chips. 2-Ethylpyrazine is a flavouring ingredient. It is found in many foods, some of which are nuts, crustaceans, cocoa and cocoa products, and cereals and cereal products. 2-Ethylpyrazine is an endogenous metabolite.

   

2,2-Dihydroperoxypropane

(1-Methylethylidene)bis[hydroperoxide], 9ci

C3H8O4 (108.0422568)


2,2-Dihydroperoxypropane is a mixture of acetone peroxides (usually supplied adsorbed onto an inert carrier such as cornstarch) is added to foods as a beleaching agent and dough conditone A mixture of acetone peroxides (usually supplied adsorbed onto an inert carrier such as cornstarch) is added to foods as a beleaching agent and dough conditoner

   

(Z)-1,3-Octadiene

(1Z,3E)-cycloocta-1,3-diene

C8H12 (108.09389519999999)


(Z)-1,3-Octadiene belongs to the class of organic compounds known as cycloalkenes. These are compounds containing a non-aromatic closed ring of carbon atoms in which at least 2 atoms are connected by a double bond.

   

(2R)-3-Sulfanylpropane-1,2-diol

(2R)-3-Sulphanylpropane-1,2-diol

C3H8O2S (108.0244988)


   

Vinylcyclohexene

1-ethenylcyclohex-1-ene

C8H12 (108.09389519999999)


   

4-Chloro-1-butanol

Hydroxypropyl methyl chloride

C4H9ClO (108.03418940000002)


   

2-Amino-4-methylpyridine

4-methyl-1,2-dihydropyridin-2-imine

C6H8N2 (108.06874479999999)


   
   
   

Furofuran

furo[3,2-b]furan

C6H4O2 (108.0211284)


   

Glycerol oxide

Glycerol oxide

C3H8O4 (108.0422568)


   

trans-Allo-ocimene

(2E,4E,6E)-octa-2,4,6-triene

C8H12 (108.09389519999999)


Trans-allo-ocimene is a member of the class of compounds known as alkatrienes. Alkatrienes are acyclic hydrocarbons that contain exactly three carbon-to-carbon double bonds. Trans-allo-ocimene can be found in common sage, sweet basil, and tarragon, which makes trans-allo-ocimene a potential biomarker for the consumption of these food products.

   

(3E,5E)-1,3,5-octatriene

(3E,5E)-octa-1,3,5-triene

C8H12 (108.09389519999999)


Flavouring compound [Flavornet]

   
   

Dinitrile-Hexanedioic acid,9CI

Dinitrile-Hexanedioic acid,9CI

C6H8N2 (108.06874479999999)


   

SCHEMBL8515219

SCHEMBL8515219

C3H8O4 (108.0422568)


   

1,3-Dimethyldihydrobenzene

1,3-Dimethyldihydrobenzene

C8H12 (108.09389519999999)


   
   

Chlorotrimethylsilane

Chlorotrimethylsilane

C3H9ClSi (108.01620240000001)


D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents

   
   

Nitrile-5-Methyl-3-isoxazolecarboxylic acid,9CI

Nitrile-5-Methyl-3-isoxazolecarboxylic acid,9CI

C5H4N2O (108.0323614)


   

(-)-Hepta-1,3-diin-5-ol|(3S)-(-)-hepta-4,6-diyn-3-ol|(5S)-hepta-1,3-diyn-5-ol|(S)-hepta-4,6-diyn-3-ol|4,6-Heptadiyn-3-ol

(-)-Hepta-1,3-diin-5-ol|(3S)-(-)-hepta-4,6-diyn-3-ol|(5S)-hepta-1,3-diyn-5-ol|(S)-hepta-4,6-diyn-3-ol|4,6-Heptadiyn-3-ol

C7H8O (108.0575118)


   
   

Aminopicoline

2-amino-4-methylpyridine

C6H8N2 (108.06874479999999)


COVID info from PDB, Protein Data Bank Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

   

benzyl alcohol

benzyl alcohol

C7H8O (108.0575118)


Benzyl alcohol is an aromatic alcohol, a colorless liquid with a mild aromatic odor. Benzyl alcohol is an aromatic alcohol, a colorless liquid with a mild aromatic odor.

   

P-CRESOL

P-CRESOL

C7H8O (108.0575118)


A cresol that consists of toluene substituted by a hydroxy group at position 4. It is a metabolite of aromatic amino acid metabolism produced by intestinal microflora in humans and animals.

   

m-cresol

m-cresol

C7H8O (108.0575118)


A cresol with the methyl substituent at position 3. It is a minor urinary metabolite of toluene.

   

o-cresol

o-cresol

C7H8O (108.0575118)


A cresol that is phenol substituted by a methyl group at position 2. It is a minor urinary metabolite of toluene.

   

Quinone

1,4-Benzoquinone

C6H4O2 (108.0211284)


   
   

Para-cresol

Para-cresol

C7H8O (108.0575118)


   

phenylmethanol

Hydroxymethylpolystyrene resin

C7H8O (108.0575118)


P - Antiparasitic products, insecticides and repellents > P03 - Ectoparasiticides, incl. scabicides, insecticides and repellents > P03A - Ectoparasiticides, incl. scabicides D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D000777 - Anesthetics An aromatic alcohol that consists of benzene bearing a single hydroxymethyl substituent. D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents C254 - Anti-Infective Agent > C28394 - Topical Anti-Infective Agent COVID info from PDB, Protein Data Bank Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS Benzyl alcohol is an aromatic alcohol, a colorless liquid with a mild aromatic odor. Benzyl alcohol is an aromatic alcohol, a colorless liquid with a mild aromatic odor.

   

2,5-DIMETHYLPYRAZINE

"2,5-DIMETHYLPYRAZINE"

C6H8N2 (108.06874479999999)


2,5-Dimethylpyrazine is an endogenous metabolite. 2,5-Dimethylpyrazine is an endogenous metabolite.

   

2-chloro-N-nitroso-Ethanamine (Carmustine Metabolite)

2-chloro-N-nitroso-Ethanamine (Carmustine Metabolite)

C2H5ClN2O (108.009039)


   

Moldin

2-Ethyl-1,4-diazine

C6H8N2 (108.06874479999999)


2-Ethylpyrazine is an endogenous metabolite.

   

FEMA 3271

2,3-Dimethyl-1,4-diazine

C6H8N2 (108.06874479999999)


   

Peroxyacetone

(1-Methylethylidene)bis[hydroperoxide], 9ci

C3H8O4 (108.0422568)


   

FEMA 3273

2,6-Dimethyl-1,4-diazine

C6H8N2 (108.06874479999999)


2,6-Dimethylpyrazine is a key aroma compound in Boletus edulis[1]. 2,6-Dimethylpyrazine is a key aroma compound in Boletus edulis[1].

   

2,5-Dimethylpyrazine

2,5-Dimethyl-1,4-diazine

C6H8N2 (108.06874479999999)


2,5-Dimethylpyrazine is an endogenous metabolite. 2,5-Dimethylpyrazine is a natural product found in Streptomyces antioxidans, Zea mays. 2,5-Dimethylpyrazine is a metabolite found in or produced by Saccharomyces cerevisiae. 2,5-Dimethylpyrazine. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=123-32-0 (retrieved 2024-08-21) (CAS RN: 123-32-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

   
   
   

3,5-dimethylhex-3-en-1-yne

3,5-dimethylhex-3-en-1-yne

C8H12 (108.09389519999999)


   

ANISOLE

ANISOLE

C7H8O (108.0575118)


A monomethoxybenzene that is benzene substituted by a methoxy group.

   

5-Pyrimidinecarbaldehyde

5-Pyrimidinecarbaldehyde

C5H4N2O (108.0323614)


   

lithium,ethynylbenzene

lithium,ethynylbenzene

C8H5Li (108.055128)


   

Bicyclo[3.2.0]hept-2-en-6-one

Bicyclo[3.2.0]hept-2-en-6-one

C7H8O (108.0575118)


   
   

2-chloro-acetamide oxime

2-chloro-acetamide oxime

C2H5ClN2O (108.009039)


   
   
   
   
   

3-(2H4)Pyridinecarbonitrile

3-(2H4)Pyridinecarbonitrile

C6D4N2 (108.062555112)


   

1,3-Oxazol-2-ylacetonitrile

1,3-Oxazol-2-ylacetonitrile

C5H4N2O (108.0323614)


   

4,4,4-trifluorobuta-1,2-diene

4,4,4-trifluorobuta-1,2-diene

C4H3F3 (108.01868339999999)


   
   

N-(2H3)Ethanoyl(2H4)acetamide

N-(2H3)Ethanoyl(2H4)acetamide

C4D7NO2 (108.091616446)


   
   

butylene chlorohydrin

butylene chlorohydrin

C4H9ClO (108.03418940000002)


A secondary alcohol that is butan-2-ol in which one of the methyl hydrogen atoms is substituted by chlorine.

   

4-Amino-1H-pyrazole-3-carbonitrile

4-Amino-1H-pyrazole-3-carbonitrile

C4H4N4 (108.04359439999999)


   
   
   

1H,4H,5H,6H-cyclopenta[c]pyrazole

1H,4H,5H,6H-cyclopenta[c]pyrazole

C6H8N2 (108.06874479999999)


   

2-chloroacetohydrazide

2-chloroacetohydrazide

C2H5ClN2O (108.009039)


   
   

Pyrimidine-4-carbaldehyde

Pyrimidine-4-carbaldehyde

C5H4N2O (108.0323614)


   

5-Methylisoxazole-3-carbonitrile

5-Methyl-1,2-oxazole-3-carbonitrile

C5H4N2O (108.0323614)


   

Cyclopropylhydrazine hydrochloride (1:1)

Cyclopropylhydrazine hydrochloride (1:1)

C3H9ClN2 (108.0454224)


   

(2H5)Benzonitrile

(2H5)Benzonitrile

C7D5N (108.07358289)


   
   
   

1-allylhydrazine hydrochloride

1-allylhydrazine hydrochloride

C3H9ClN2 (108.0454224)


   

3-Ethyl-1-methyl-1,3-cyclopentadiene

3-Ethyl-1-methyl-1,3-cyclopentadiene

C8H12 (108.09389519999999)


   
   
   

ETHYL METHYLPHOSPHINATE

ETHYL METHYLPHOSPHINATE

C3H9O2P (108.0340144)


   

1H-Imidazole,1-ethenyl-2-methyl-

1H-Imidazole,1-ethenyl-2-methyl-

C6H8N2 (108.06874479999999)


   

1,5-dimethylcyclohexa-1,4-diene

1,5-dimethylcyclohexa-1,4-diene

C8H12 (108.09389519999999)


   
   

1,4-dimethylidenecyclohexane

1,4-dimethylidenecyclohexane

C8H12 (108.09389519999999)


   
   
   

(2H3)Methyl 2-(2H3)methyl(2H2)-2-propenoate

(2H3)Methyl 2-(2H3)methyl(2H2)-2-propenoate

C5D8O2 (108.102644224)


   

methoxybenzene

methoxybenzene

C7H8O (108.0575118)


   

Sodium polymethacrylate

Sodium polymethacrylate

C4H5NaO2 (108.01872300000001)


It is used as a food additive .

   

1,2-dimethylidenecyclohexane

1,2-dimethylidenecyclohexane

C8H12 (108.09389519999999)


   
   
   

1,4,5,6-TETRAHYDRO-PYRIDINE-3-CARBONITRILE

1,4,5,6-TETRAHYDRO-PYRIDINE-3-CARBONITRILE

C6H8N2 (108.06874479999999)


   

Pyrimidine, 5-ethyl- (6CI,8CI,9CI)

Pyrimidine, 5-ethyl- (6CI,8CI,9CI)

C6H8N2 (108.06874479999999)


   

1H-IMidazole, 1-cyclopropyl-

1H-IMidazole, 1-cyclopropyl-

C6H8N2 (108.06874479999999)


   
   

4-methyloxazole-5-carbonitrile

4-methyloxazole-5-carbonitrile

C5H4N2O (108.0323614)


   
   
   

(2H)Ethynyl(2H5)benzene

(2H)Ethynyl(2H5)benzene

C8D6 (108.084610668)


   
   

4-Methylphenol

4-Methylphenol

C7H8O (108.0575118)


   
   

(2,2-Difluorocyclopropyl)methanol

(2,2-Difluorocyclopropyl)methanol

C4H6F2O (108.038669)


   

2-Amino-1-cyclopentene-1-carbonitrile

2-Amino-1-cyclopentene-1-carbonitrile

C6H8N2 (108.06874479999999)


   

2-methyl-1,3-oxazole-4-carbonitrile

2-methyl-1,3-oxazole-4-carbonitrile

C5H4N2O (108.0323614)


   
   
   
   

4H,5H,6H-pyrrolo[1,2-b]pyrazole

4H,5H,6H-pyrrolo[1,2-b]pyrazole

C6H8N2 (108.06874479999999)


   
   
   

1-sulfanylpropane-1,1-diol

1-sulfanylpropane-1,1-diol

C3H8O2S (108.0244988)


   
   
   
   

1H-1,2,4-Triazol-1-ylacetonitrile

1H-1,2,4-Triazol-1-ylacetonitrile

C4H4N4 (108.04359439999999)


   
   
   
   
   

Lithium 3-oxobutanoate

Lithium 3-oxobutanoate

C4H5LiO3 (108.039873)


Acetoacetic acid lithium is an endogenous metabolite.

   

1-NAPHTHALENEACETICACIDETHYLESTER

1-NAPHTHALENEACETICACIDETHYLESTER

C3H8O2S (108.0244988)


   

(2H3)Ethanoic anhydride

(2H3)Ethanoic anhydride

C4D6O3 (108.069355668)


   

3-fluoro-D-(2-2H)alanine

3-fluoro-D-(2-2H)alanine

C3H5DFNO2 (108.044531978)


   

1-methylsiline

1-methylsiline

C6H8Si (108.0395248)


   

dideuterio(phenyl)methanol

dideuterio(phenyl)methanol

C7H8O (108.0575118)


   

2-Pyrimidinecarbaldehyde

2-Pyrimidinecarbaldehyde

C5H4N2O (108.0323614)


   
   

2-Aminofuran-3-carbonitrile

2-Aminofuran-3-carbonitrile

C5H4N2O (108.0323614)


   
   

1,1,2-Trifluoro-1,3-butadiene

1,1,2-Trifluoro-1,3-butadiene

C4H3F3 (108.01868339999999)


   

Ethyl Methyl Sulfone

Ethyl Methyl Sulfone

C3H8O2S (108.0244988)


   

trimethylphosphine sulfide

trimethylphosphine sulfide

C3H9PS (108.0162564)


   

4-Cyclopropyl-1(3)H-imidazole

4-Cyclopropyl-1(3)H-imidazole

C6H8N2 (108.06874479999999)


   
   

POLY(HEXAMETHYLENEVINYLENE) MIXTURE OF&

POLY(HEXAMETHYLENEVINYLENE) MIXTURE OF&

C8H12 (108.09389519999999)


   

1-deuteriooxy-2-(2-deuteriooxyethoxy)ethane

1-deuteriooxy-2-(2-deuteriooxyethoxy)ethane

C4H8D2O3 (108.075545356)


   
   

1,5-difluoropentane

1,5-difluoropentane

C5H10F2 (108.0750524)


   
   
   

2-Pyrazinecarbaldehyde

2-Pyrazinecarbaldehyde

C5H4N2O (108.0323614)


   
   
   

Bicyclo[2.2.1]hept-5-en-2-one

Bicyclo[2.2.1]hept-5-en-2-one

C7H8O (108.0575118)


   

dideuterio 2,2-dideuteriopropanedioate

dideuterio 2,2-dideuteriopropanedioate

C3D4O4 (108.03606711200001)


   
   
   
   
   

4-Pyridazinecarbaldehyde

4-Pyridazinecarbaldehyde

C5H4N2O (108.0323614)


   

5-Amino-1H-imidazol-4-carbonitrile

5-Amino-1H-imidazol-4-carbonitrile

C4H4N4 (108.04359439999999)


   

6,7-Dihydro-5H-pyrrolo[1,2-a]imidazole

6,7-Dihydro-5H-pyrrolo[1,2-a]imidazole

C6H8N2 (108.06874479999999)


   

3-Pyridazinecarbaldehyde

3-Pyridazinecarbaldehyde

C5H4N2O (108.0323614)


   

2-Methyl-5-methylene-2-cyclopenten-1-one

2-Methyl-5-methylene-2-cyclopenten-1-one

C7H8O (108.0575118)


   

3,4-Dihydrobenzaldehyde

3,4-Dihydrobenzaldehyde

C7H8O (108.0575118)


   

1H-Pyrazole-3-carbonitrile,5-amino-(9CI)

1H-Pyrazole-3-carbonitrile,5-amino-(9CI)

C4H4N4 (108.04359439999999)


   

2,3-diaminobut-2-enedinitrile

2,3-diaminobut-2-enedinitrile

C4H4N4 (108.04359439999999)


   
   
   
   

1,3-BIS(PHOSPHINO)PROPANE

1,3-BIS(PHOSPHINO)PROPANE

C3H10P2 (108.025772)


   

Propionimidamide hydrochloride

Propionimidamide hydrochloride

C3H9ClN2 (108.0454224)


   

1,1-vinylidenebiscyclopropane

1,1-vinylidenebiscyclopropane

C8H12 (108.09389519999999)


   
   
   

4,4,5-trideuterio-5-(trideuteriomethyl)-1,3-dioxolan-2-one

4,4,5-trideuterio-5-(trideuteriomethyl)-1,3-dioxolan-2-one

C4D6O3 (108.069355668)


   
   

5-Amino-1H-pyrazole-4-carbonitrile

5-Amino-1H-pyrazole-4-carbonitrile

C4H4N4 (108.04359439999999)


   

2-acetylpropanedinitrile

2-acetylpropanedinitrile

C5H4N2O (108.0323614)


   
   
   

1-fluoro-3-methoxypropan-2-ol

1-fluoro-3-methoxypropan-2-ol

C4H9FO2 (108.0586546)


   

anti-3-Oxotricyclo[2.2.1.02,6]heptane-7-carboxylic acid

anti-3-Oxotricyclo[2.2.1.02,6]heptane-7-carboxylic acid

C7H8O (108.0575118)


   

1,4-Cyclohexadiene,1-ethyl-

1,4-Cyclohexadiene,1-ethyl-

C8H12 (108.09389519999999)


   

Bicyclo[2.2.1]hept-2-ene,2-methyl-

Bicyclo[2.2.1]hept-2-ene,2-methyl-

C8H12 (108.09389519999999)


   

3-methyl-5-isoxazolecarbonitrile(SALTDATA: FREE)

3-methyl-5-isoxazolecarbonitrile(SALTDATA: FREE)

C5H4N2O (108.0323614)


   

3,3-Difluorocyclobutanol

3,3-Difluorocyclobutanol

C4H6F2O (108.038669)


   
   

(2R)-3-Sulfanylpropane-1,2-diol

(2R)-3-Sulfanylpropane-1,2-diol

C3H8O2S (108.0244988)


   
   
   
   
   

(2S)-3-fluoro-2-hydroxypropanoic acid

(2S)-3-fluoro-2-hydroxypropanoic acid

C3H5FO3 (108.0222712)


   

CPD-112

Celcure Dry Mix (chemicals for wood preserving)

C7H8O (108.0575118)


   

LS-307

4-06-00-02222 (Beilstein Handbook Reference)

C7H8O (108.0575118)


P - Antiparasitic products, insecticides and repellents > P03 - Ectoparasiticides, incl. scabicides, insecticides and repellents > P03A - Ectoparasiticides, incl. scabicides D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D000777 - Anesthetics D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents C254 - Anti-Infective Agent > C28394 - Topical Anti-Infective Agent COVID info from PDB, Protein Data Bank Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS Benzyl alcohol is an aromatic alcohol, a colorless liquid with a mild aromatic odor. Benzyl alcohol is an aromatic alcohol, a colorless liquid with a mild aromatic odor.

   

Cresols

InChI=1\C7H8O\c1-6-2-4-7(8)5-3-6\h2-5,8H,1H

C7H8O (108.0575118)


   

5910-89-4

InChI=1\C6H8N2\c1-5-6(2)8-4-3-7-5\h3-4H,1-2H

C6H8N2 (108.06874479999999)


   

Anizol

InChI=1\C7H8O\c1-8-7-5-3-2-4-6-7\h2-6H,1H

C7H8O (108.0575118)


   

Chinone

2,5-Cyclohexadiene-1,4-dione, radical ion(1-)

C6H4O2 (108.0211284)


D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents

   

CPD-109

InChI=1\C7H8O\c1-6-4-2-3-5-7(6)8\h2-5,8H,1H

C7H8O (108.0575118)


   

AI3-26696

InChI=1\C8H12\c1-2-4-6-8-7-5-3-1\h1-4H,5-8H2\b3-1-,4-2

C8H12 (108.09389519999999)


   

AI3-60303

InChI=1\C6H8N2\c1-5-3-8-6(2)4-7-5\h3-4H,1-2H

C6H8N2 (108.06874479999999)


2,5-Dimethylpyrazine is an endogenous metabolite. 2,5-Dimethylpyrazine is an endogenous metabolite.

   

108-50-9

InChI=1\C6H8N2\c1-5-3-7-4-6(2)8-5\h3-4H,1-2H

C6H8N2 (108.06874479999999)


2,6-Dimethylpyrazine is a key aroma compound in Boletus edulis[1]. 2,6-Dimethylpyrazine is a key aroma compound in Boletus edulis[1].

   

Benzylaminium

Benzylaminium

C7H10N+ (108.08132)


The conjugate acid of benzylamine; major product at pH 7.3.

   

Ortho-benzosemiquinone

Ortho-benzosemiquinone

C6H4O2- (108.0211284)


   
   

2-Aminoethanesulfinate

2-Aminoethanesulfinate

C2H6NO2S- (108.0119236)


   
   

Benzene-1,2-diolate

Benzene-1,2-diolate

C6H4O2-2 (108.0211284)


   

(Hydroxymethyl)(methyl)silanediol

(Hydroxymethyl)(methyl)silanediol

C2H8O3Si (108.0242698)


   

2-Dimethylammonioethyl chloride

2-Dimethylammonioethyl chloride

C4H11ClN+ (108.0579976)


   

p-Phenylenediamine

p-Phenylenediamine

C6H8N2 (108.06874479999999)


D004396 - Coloring Agents

   

1,4-Benzoquinone

1,4-Benzoquinone

C6H4O2 (108.0211284)


The simplest member of the class of 1,4-benzoquinones, obtained by the formal oxidation of hydroquinone to the corresponding diketone. It is a metabolite of benzene. D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents

   

PHENYLHYDRAZINE

PHENYLHYDRAZINE

C6H8N2 (108.06874479999999)


D009676 - Noxae > D016877 - Oxidants

   
   
   

1,2-Benzoquinone

1,2-Benzoquinone

C6H4O2 (108.0211284)


   
   

3-Mercaptopropane-1,2-diol

3-Mercaptopropane-1,2-diol

C3H8O2S (108.0244988)


   

2,6-DIMETHYLPYRAZINE

2,6-DIMETHYLPYRAZINE

C6H8N2 (108.06874479999999)


2,6-Dimethylpyrazine is a key aroma compound in Boletus edulis[1]. 2,6-Dimethylpyrazine is a key aroma compound in Boletus edulis[1].

   
   

2-ETHYLPYRAZINE

2-ETHYLPYRAZINE

C6H8N2 (108.06874479999999)


2-Ethylpyrazine is an endogenous metabolite.

   

4-chlorobutanol

4-chlorobutanol

C4H9ClO (108.03418940000002)


A primary alcohol that is butan-1-ol substituted by a chloro group at position 4.

   

2,2-Dihydroperoxypropane

2,2-Dihydroperoxypropane

C3H8O4 (108.0422568)


   
   

hypotaurine(1-)

hypotaurine(1-)

C2H6NO2S (108.0119236)


An organosulfinate oxoanion resulting from the deprotonation of the sulfinic acid group of hypotaurine.

   

catecholate(2-)

catecholate(2-)

C6H4O2 (108.0211284)


A phenolate anion that is the conjugate base of catecholate(1-).