Exact Mass: 200.077

Exact Mass Matches: 200.077

Found 228 metabolites which its exact mass value is equals to given mass value 200.077, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Bisphenol F

4,4-Methylenebis(phenol), disodium salt

C13H12O2 (200.0837)


4,4'-Dihydroxydiphenylmethane is a phenolic derivative with antioxidant activities[1]. 4,4'-Dihydroxydiphenylmethane is a phenolic derivative with antioxidant activities[1].

   

(3-Phenoxyphenyl)methanol

1-Hydroxymethyl-3-phenoxybenzene

C13H12O2 (200.0837)


   

Dihydroclavaminate

Dihydroclavaminic acid; Dihydroclavaminate

C8H12N2O4 (200.0797)


   

3,4-Dihydro-9H-fluorene-3,4-diol

(+)-(3S,4R)-cis-3,4-Dihydroxy-3,4-dihydrofluorene

C13H12O2 (200.0837)


   

Safynol

(2R,3E,11E)-3,11-Tridecadiene-5,7,9-triyne-1,2-diol

C13H12O2 (200.0837)


Isolated from diseased Carthamus tinctorius (safflower). Safynol is found in safflower, fats and oils, and herbs and spices. Safynol is found in fats and oils. Safynol is isolated from diseased Carthamus tinctorius (safflower).

   

Dehydrotremetone

1-[2-(prop-1-en-2-yl)-1-benzofuran-5-yl]ethan-1-one

C13H12O2 (200.0837)


   

Monobenzone

MONOBENZYL ether OF hydroquinone

C13H12O2 (200.0837)


Monobenzone is the monobenzyl ether of hydroquinone used medically for depigmentation. Monobenzone occurs as a white, almost tasteless crystalline powder, soluble in alcohol and practically insoluble in water. The topical application of monobenzone in animals increases the excretion of melanin from the melanocytes. The same action is thought to be responsible for the depigmenting effect of the drug in humans. Monobenzone may cause destruction of melanocytes and permanent depigmentation. D - Dermatologicals Same as: D05072

   

2,2'-Methylenediphenol

2-[(2-hydroxyphenyl)methyl]phenol

C13H12O2 (200.0837)


CONFIDENCE standard compound; INTERNAL_ID 860; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4380; ORIGINAL_PRECURSOR_SCAN_NO 4378 CONFIDENCE standard compound; INTERNAL_ID 860; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4391; ORIGINAL_PRECURSOR_SCAN_NO 4390 CONFIDENCE standard compound; INTERNAL_ID 860; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4432; ORIGINAL_PRECURSOR_SCAN_NO 4427 CONFIDENCE standard compound; INTERNAL_ID 860; DATASET 20200303_ENTACT_RP_MIX500; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4033; ORIGINAL_PRECURSOR_SCAN_NO 4030 CONFIDENCE standard compound; INTERNAL_ID 860; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4411; ORIGINAL_PRECURSOR_SCAN_NO 4406 CONFIDENCE standard compound; INTERNAL_ID 860; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4412; ORIGINAL_PRECURSOR_SCAN_NO 4408

   

Alanylclavam

3-(7-Oxo-1-aza-4-oxabicyclo(3.2.0)hept-3-yl)alanine

C8H12N2O4 (200.0797)


D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D002969 - Clavulanic Acids D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams

   

Nellite

phenyl N,N-dimethylphosphorodiamidate

C8H13N2O2P (200.0715)


   

3-[(1R,2S,5R,6S)-5-hydroxy-7-oxabicyclo[4.1.0]heptan-2-yl]pyruvic acid

3-[(1R,2S,5R,6S)-5-Hydroxy-7-oxabicyclo[4.1.0]heptan-2-yl]-2-oxopropanoate; Epoxy-4S-H4HPP

C9H12O5 (200.0685)


A 2-oxo monocarboxylic acid that is pyruvic acid in which one of the methyl hydrogens is replaced by a 5-hydroxy-7-oxabicyclo[4.1.0]heptan-2-yl group (the 1R,2S,5R,6S stereoisomer).

   

3,6-Dihydro-4-(4-methyl-3-pentenyl)-1,2-dithiin

4-(4-methylpent-3-en-1-yl)-3,6-dihydro-1,2-dithiine

C10H16S2 (200.0693)


3,6-Dihydro-4-(4-methyl-3-pentenyl)-1,2-dithiin is found in alcoholic beverages. 3,6-Dihydro-4-(4-methyl-3-pentenyl)-1,2-dithiin is a constituent of hops

   

(Z)-3-(1-Butenyl)-1H-2-benzopyran-1-one

3-[(1Z)-but-1-en-1-yl]-1H-isochromen-1-one

C13H12O2 (200.0837)


(E)-3-(1-Butenyl)-1H-2-benzopyran-1-one is found in herbs and spices. (E)-3-(1-Butenyl)-1H-2-benzopyran-1-one is a constituent of Artemisia dracunculus (tarragon)

   

(Z)-3-(1-Formyl-1-propenyl)pentanedioic acid

3-[(2Z)-1-oxobut-2-en-2-yl]pentanedioic acid

C9H12O5 (200.0685)


(Z)-3-(1-Formyl-1-propenyl)pentanedioic acid is found in fats and oils. (Z)-3-(1-Formyl-1-propenyl)pentanedioic acid is a constituent of olives (Olea europaea). Constituent of olives (Olea europaea). (Z)-3-(1-Formyl-1-propenyl)pentanedioic acid is found in fats and oils, herbs and spices, and fruits.

   

2-[Hydroxy(phenyl)methyl]phenol

2-[Hydroxy(phenyl)methyl]phenol

C13H12O2 (200.0837)


   

1-(4-Methoxy-1-naphthyl)ethanone

1-(4-methoxynaphthalen-1-yl)ethan-1-one

C13H12O2 (200.0837)


   

1-(2-Hydroxyethoxy)methyl-5-methyluracil

1-[(2-hydroxyethoxy)methyl]-5-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione

C8H12N2O4 (200.0797)


   

(3S,8As)-7-hydroxy-3-(hydroxymethyl)-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione

(3S,8As)-7-hydroxy-3-(hydroxymethyl)-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione

C8H12N2O4 (200.0797)


   

4-Deoxy-2,3-dihydromycosinol

2-(hexa-2,4-diyn-1-ylidene)-1,6-dioxaspiro[4.4]non-3-ene

C13H12O2 (200.0837)


4-deoxy-2,3-dihydromycosinol is a member of the class of compounds known as ketals. Ketals are acetals derived from ketones by replacement of the oxo group by two hydrocarbyloxy groups R2C(OR)2 ( R not Hydrogen ). This term, once abandoned, has been reinstated as a subclass of acetals. 4-deoxy-2,3-dihydromycosinol is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). 4-deoxy-2,3-dihydromycosinol can be found in roman camomile, which makes 4-deoxy-2,3-dihydromycosinol a potential biomarker for the consumption of this food product.

   

(7E)-4-Deoxy-2,3-dihydromycosinol

(2E)-2-(hexa-2,4-diyn-1-ylidene)-1,6-dioxaspiro[4.4]non-3-ene

C13H12O2 (200.0837)


(7e)-4-deoxy-2,3-dihydromycosinol, also known as tonghaosu, is a member of the class of compounds known as ketals. Ketals are acetals derived from ketones by replacement of the oxo group by two hydrocarbyloxy groups R2C(OR)2 ( R not Hydrogen ). This term, once abandoned, has been reinstated as a subclass of acetals (7e)-4-deoxy-2,3-dihydromycosinol is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). (7e)-4-deoxy-2,3-dihydromycosinol can be found in german camomile, which makes (7e)-4-deoxy-2,3-dihydromycosinol a potential biomarker for the consumption of this food product.

   

7-Hydroxy viteoid II

(-)-7-Hydroxy viteoid II

C9H12O5 (200.0685)


   

(6R)-(+)-Goniothalamin; (R)-(+)-Goniothalamin; (R)-Goniothalamin

(6R)-(+)-Goniothalamin; (R)-(+)-Goniothalamin; (R)-Goniothalamin

C13H12O2 (200.0837)


   

Rehmaglutin C

Rehmaglutin C

C9H12O5 (200.0685)


   

3-Methoxy-5-phenylphenol

3-hydroxy-5-methoxybiphenyl

C13H12O2 (200.0837)


   

Vertipyronediol

Vertipyronediol

C9H12O5 (200.0685)


   

3-Hydroxymethyl-s-triazolo[3,4-a]phthalazine

3-Hydroxymethyl-s-triazolo[3,4-a]phthalazine

C10H8N4O (200.0698)


   

1,2-dihydroxytrideca-5,7,9,11-tetrayne

1,2-dihydroxytrideca-5,7,9,11-tetrayne

C13H12O2 (200.0837)


   

(E) en-yn-dicycloether|(E)-2-(2,4-hexadiynylidene)-1,6-dioxaspiro[4.4]non-3-ene|(E)-2-(2,4-hexadiynylidene)-1,6-dioxaspiro[4,4]non-3-ene|(E)-tonghaosu|2-(2,4-Hexadiynylidene)-1,6-dioxaspiro[4,4]non-3-ene|2-(Hexa-2,4-diyn-1-ylidene)-1,6-dioxaspiro[4,4]non-3-ene|cis-2-(2,4-Hexadiinyliden)-1,6-dioxaspiro[5,5]nonen-(3)|cis-2-(6-(3H)-2,4-Hexadiinyliden)1,6-dioxaspiro[5,5]nonen-(3)|cis-2-<6-(3H)-2,4-Hexadiinyliden>1,6-dioxaspiro<5,5>nonen-(3)

(E) en-yn-dicycloether|(E)-2-(2,4-hexadiynylidene)-1,6-dioxaspiro[4.4]non-3-ene|(E)-2-(2,4-hexadiynylidene)-1,6-dioxaspiro[4,4]non-3-ene|(E)-tonghaosu|2-(2,4-Hexadiynylidene)-1,6-dioxaspiro[4,4]non-3-ene|2-(Hexa-2,4-diyn-1-ylidene)-1,6-dioxaspiro[4,4]non-3-ene|cis-2-(2,4-Hexadiinyliden)-1,6-dioxaspiro[5,5]nonen-(3)|cis-2-(6-(3H)-2,4-Hexadiinyliden)1,6-dioxaspiro[5,5]nonen-(3)|cis-2-<6-(3H)-2,4-Hexadiinyliden>1,6-dioxaspiro<5,5>nonen-(3)

C13H12O2 (200.0837)


   

antirrhinolide

antirrhinolide

C9H12O5 (200.0685)


   

3,5-Tridecadiene-7,9,11-triyne-1,2-diol

3,5-Tridecadiene-7,9,11-triyne-1,2-diol

C13H12O2 (200.0837)


   

1-Aldehyde,Me ester-4-Hydroxy-3-(3-methyl-3-buten-1-ynyl)benzoic acid|4-methoxy-3-(3-methylbut-3-en-1-ynyl)benzaldehyde|4-methoxy-3-(3-methylbut-3-en-1-yl)benzaldehyde|4-methoxy-3-(3-methylbut-3-en-1-ynyl)benzaldehyde|eutypine|eutypine methyl ether|methyleutypine

1-Aldehyde,Me ester-4-Hydroxy-3-(3-methyl-3-buten-1-ynyl)benzoic acid|4-methoxy-3-(3-methylbut-3-en-1-ynyl)benzaldehyde|4-methoxy-3-(3-methylbut-3-en-1-yl)benzaldehyde|4-methoxy-3-(3-methylbut-3-en-1-ynyl)benzaldehyde|eutypine|eutypine methyl ether|methyleutypine

C13H12O2 (200.0837)


   

trideca-1,5t-diene-7,9,11-triyne-3,4-diol|Tridecadiin-(7.9.11)-dien-(1.5t)-diol-(3.4)

trideca-1,5t-diene-7,9,11-triyne-3,4-diol|Tridecadiin-(7.9.11)-dien-(1.5t)-diol-(3.4)

C13H12O2 (200.0837)


   

methyl 4-methylazulene-1-carboxylate

methyl 4-methylazulene-1-carboxylate

C13H12O2 (200.0837)


   

2,3-Dihydro-2-methylnaphtho[1,8-bc]pyran-5-ol

2,3-Dihydro-2-methylnaphtho[1,8-bc]pyran-5-ol

C13H12O2 (200.0837)


   

DTXSID50815606

DTXSID50815606

C10H8N4O (200.0698)


   

1beta-Scabrogenin|beta-scabrogenin

1beta-Scabrogenin|beta-scabrogenin

C9H12O5 (200.0685)


   

7-phenyl-hepta-4,6-diyn-1,2-diol

7-phenyl-hepta-4,6-diyn-1,2-diol

C13H12O2 (200.0837)


   

6-(Hydroxymethyl)-8-hydroxy-3,4,5,6-tetrahydro-1H,8H-pyrano[3,4-c]pyran-1-one

6-(Hydroxymethyl)-8-hydroxy-3,4,5,6-tetrahydro-1H,8H-pyrano[3,4-c]pyran-1-one

C9H12O5 (200.0685)


   

chrysindin A

chrysindin A

C13H12O2 (200.0837)


   

1,4-Naphthalenedione, 2,3,6-trimethyl-

1,4-Naphthalenedione, 2,3,6-trimethyl-

C13H12O2 (200.0837)


   

2,4-Dihydroxydiphenylmethane

2,4-Dihydroxydiphenylmethane

C13H12O2 (200.0837)


CONFIDENCE standard compound; INTERNAL_ID 976; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4391; ORIGINAL_PRECURSOR_SCAN_NO 4390 CONFIDENCE standard compound; INTERNAL_ID 976; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4412; ORIGINAL_PRECURSOR_SCAN_NO 4408 CONFIDENCE standard compound; INTERNAL_ID 976; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4380; ORIGINAL_PRECURSOR_SCAN_NO 4378 CONFIDENCE standard compound; INTERNAL_ID 976; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4411; ORIGINAL_PRECURSOR_SCAN_NO 4406 CONFIDENCE standard compound; INTERNAL_ID 976; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4432; ORIGINAL_PRECURSOR_SCAN_NO 4427 CONFIDENCE standard compound; INTERNAL_ID 976; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4444; ORIGINAL_PRECURSOR_SCAN_NO 4439

   

3-hydroxy-5-methoxybiphenyl

3-hydroxy-5-methoxybiphenyl

C13H12O2 (200.0837)


A natural product found in Rhaphiolepis indica var. tashiroi.

   

Astepyrone

Astepyrone

C9H12O5 (200.0685)


   

(2R*,3R*)-7-Phenyl-4,6-heptadiyne-2,3-diol

(2R*,3R*)-7-Phenyl-4,6-heptadiyne-2,3-diol

C13H12O2 (200.0837)


   

Macommelin-8,9-diol

Macommelin-8,9-diol

C9H12O5 (200.0685)


   

Antirrhide

Antirrhide

C9H12O5 (200.0685)


   

benzhydrylphosphane

benzhydrylphosphane

C13H13P (200.0755)


   

34W9GO6B2Z

2H-Pyran-2-one, 5,6-dihydro-6-[(E)-2-phenylethenyl]-, (6R)-

C13H12O2 (200.0837)


Goniothalamin is a natural product found in Cryptocarya latifolia, Cryptocarya wyliei, and other organisms with data available.

   

Bisphenol_F

InChI=1/C13H12O2/c14-12-5-1-10(2-6-12)9-11-3-7-13(15)8-4-11/h1-8,14-15H,9H

C13H12O2 (200.0837)


Bisphenol F is a bisphenol that is methane in which two of the hydrogens have been replaced by 4-hydroxyphenyl groups. It has a role as an environmental food contaminant and a xenoestrogen. It is a diarylmethane and a bisphenol. 4,4-Methylenediphenol is a natural product found in Galeola faberi, Xanthium strumarium, and other organisms with data available. 4,4'-Dihydroxydiphenylmethane is a phenolic derivative with antioxidant activities[1]. 4,4'-Dihydroxydiphenylmethane is a phenolic derivative with antioxidant activities[1].

   

3-Phenoxybenzylalcohol

(3-Phenoxyphenyl)methanol

C13H12O2 (200.0837)


CONFIDENCE standard compound; EAWAG_UCHEM_ID 325

   

4-Amino-6-(tert-butyl)-3-mercapto-1,2,4-triazin-5(4H)-one

4-Amino-6-tert-butyl-3-thioxo-3,4-dihydro-1,2,4-triazin-5(2H)-one

C7H12N4OS (200.0732)


CONFIDENCE standard compound; INTERNAL_ID 786; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3767; ORIGINAL_PRECURSOR_SCAN_NO 3764 CONFIDENCE standard compound; INTERNAL_ID 786; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3840; ORIGINAL_PRECURSOR_SCAN_NO 3835 CONFIDENCE standard compound; INTERNAL_ID 786; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3753; ORIGINAL_PRECURSOR_SCAN_NO 3749 CONFIDENCE standard compound; INTERNAL_ID 786; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3830; ORIGINAL_PRECURSOR_SCAN_NO 3828 CONFIDENCE standard compound; INTERNAL_ID 786; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3791; ORIGINAL_PRECURSOR_SCAN_NO 3787 CONFIDENCE standard compound; INTERNAL_ID 786; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3792; ORIGINAL_PRECURSOR_SCAN_NO 3789

   

Methyl 1-Naphthaleneacetate

Methyl 1-Naphthaleneacetate

C13H12O2 (200.0837)


CONFIDENCE standard compound; INTERNAL_ID 834; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4391; ORIGINAL_PRECURSOR_SCAN_NO 4390 CONFIDENCE standard compound; INTERNAL_ID 834; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4412; ORIGINAL_PRECURSOR_SCAN_NO 4408 CONFIDENCE standard compound; INTERNAL_ID 834; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4380; ORIGINAL_PRECURSOR_SCAN_NO 4378 CONFIDENCE standard compound; INTERNAL_ID 834; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4411; ORIGINAL_PRECURSOR_SCAN_NO 4406 CONFIDENCE standard compound; INTERNAL_ID 834; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4432; ORIGINAL_PRECURSOR_SCAN_NO 4427 CONFIDENCE standard compound; INTERNAL_ID 834; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4444; ORIGINAL_PRECURSOR_SCAN_NO 4439

   

2-(2,4-Hexadiynylidene)-1,6-dioxaspiro(4.4)non-3-ene

2-(2,4-Hexadiynylidene)-1,6-dioxaspiro(4.4)non-3-ene

C13H12O2 (200.0837)


   

Barbituric acid, 5-ethyl-5-(2-hydroxyethyl)-

Barbituric acid, 5-ethyl-5-(2-hydroxyethyl)-

C8H12N2O4 (200.0797)


   

Diphenylmethylphosphine

Methyl(diphenyl)phosphine

C13H13P (200.0755)


   

Laurencione diacetate

Laurencione diacetate

C9H12O5 (200.0685)


   

4-(4-Methyl-3-pentenyl)-1,2-dithia-4-cyclohexene

4-(4-methylpent-3-en-1-yl)-3,6-dihydro-1,2-dithiine

C10H16S2 (200.0693)


   

(Z)-3-(1-Butenyl)-1H-2-benzopyran-1-one

3-[(1Z)-but-1-en-1-yl]-1H-isochromen-1-one

C13H12O2 (200.0837)


   

(Z)-3-(1-Formyl-1-propenyl)pentanedioic acid

(Z)-3-(1-Formyl-1-propenyl)pentanedioic acid

C9H12O5 (200.0685)


   

Safynol

(2S,3E,11E)-trideca-3,11-dien-5,7,9-triyne-1,2-diol

C13H12O2 (200.0837)


   

4-(4-Methylphenoxy)phenol

4-(4-Methylphenoxy)phenol

C13H12O2 (200.0837)


   

2-Acetyl-6-methoxynaphthalene

2-Acetyl-6-methoxynaphthalene

C13H12O2 (200.0837)


   

2-piperazinopyrimidine hydrochloride

2-piperazinopyrimidine hydrochloride

C8H13ClN4 (200.0829)


   

Cyclo(-Ala-Glu)

Cyclo(-Ala-Glu)

C8H12N2O4 (200.0797)


   

1,4-DIHYDROXYOCTAHYDROQUINOXALINE-2,3-DIONE

1,4-DIHYDROXYOCTAHYDROQUINOXALINE-2,3-DIONE

C8H12N2O4 (200.0797)


   

3-(1-Naphthyl)propanoic acid

3-(1-Naphthyl)propanoic acid

C13H12O2 (200.0837)


   

1H-Pyrazole-4-carboxylicacid,3-(methoxymethoxy)-,ethylester(9CI)

1H-Pyrazole-4-carboxylicacid,3-(methoxymethoxy)-,ethylester(9CI)

C8H12N2O4 (200.0797)


   

1,3-bis(2-hydroxyethyl)uracil

1,3-bis(2-hydroxyethyl)uracil

C8H12N2O4 (200.0797)


   

ethyl 2-naphthoate

ethyl 2-naphthoate

C13H12O2 (200.0837)


   

6-Acetyl-7-methylpyrazolo[1,5-a]pyrimidine-3-carbonitrile

6-Acetyl-7-methylpyrazolo[1,5-a]pyrimidine-3-carbonitrile

C10H8N4O (200.0698)


   

Pyrimido[1,2-a]benzimidazol-4(10H)-one, 2-amino- (9CI)

Pyrimido[1,2-a]benzimidazol-4(10H)-one, 2-amino- (9CI)

C10H8N4O (200.0698)


   

Ethanimidamide,2-(phenylmethoxy)-, hydrochloride (1:1)

Ethanimidamide,2-(phenylmethoxy)-, hydrochloride (1:1)

C9H13ClN2O (200.0716)


   

2-(3-Piperidinyl)ethanamine dihydrochloride

2-(3-Piperidinyl)ethanamine dihydrochloride

C7H18Cl2N2 (200.0847)


   

4-OXO-4-(3-OXO-PIPERAZIN-1-YL)BUTYRIC ACID

4-OXO-4-(3-OXO-PIPERAZIN-1-YL)BUTYRIC ACID

C8H12N2O4 (200.0797)


   

2-Isopropylpiperazine

2-Isopropylpiperazine

C7H18Cl2N2 (200.0847)


   

1-Naphthalenecarboxylicacid, ethyl ester

1-Naphthalenecarboxylicacid, ethyl ester

C13H12O2 (200.0837)


   

ethyl 2-oxo-2-(4-oxotetrahydro-2H-pyran-3-yl)acetate

ethyl 2-oxo-2-(4-oxotetrahydro-2H-pyran-3-yl)acetate

C9H12O5 (200.0685)


   

1-ISOPROPYL-PYRROLIDIN-3-YLAMINE DIHYDROCHLORIDE

1-ISOPROPYL-PYRROLIDIN-3-YLAMINE DIHYDROCHLORIDE

C7H18Cl2N2 (200.0847)


   

(4-Phenoxyphenyl)Methanol

(4-Phenoxyphenyl)Methanol

C13H12O2 (200.0837)


   

L-Phenylalanin amide hydrochloride

L-Phenylalanin amide hydrochloride

C9H13ClN2O (200.0716)


   

2-(3-METHOXY-PHENYL)-ACETAMIDINE

2-(3-METHOXY-PHENYL)-ACETAMIDINE

C9H13ClN2O (200.0716)


   

2-Thiazolamine,4-(4-morpholinylmethyl)-

2-Thiazolamine,4-(4-morpholinylmethyl)-

C8H14N3OS (200.0858)


   

2-amino-N-benzylacetamide hydrochloride

2-amino-N-benzylacetamide hydrochloride

C9H13ClN2O (200.0716)


   

2-(Methylamino)-N-phenylacetamide hydrochloride

2-(Methylamino)-N-phenylacetamide hydrochloride

C9H13ClN2O (200.0716)


   
   

4-Ethyl-1-naphthoic acid

4-Ethyl-1-naphthoic acid

C13H12O2 (200.0837)


   

Diazene,1-(4-fluorophenyl)-2-phenyl-

Diazene,1-(4-fluorophenyl)-2-phenyl-

C12H9FN2 (200.075)


   

2-[(Trimethylsilyl)ethynyl]nicotinonitrile

2-[(Trimethylsilyl)ethynyl]nicotinonitrile

C11H12N2Si (200.077)


   

8-METHYL-2,3,4,5-TETRAHYDROPYRIDO[3,2-F][1,4]OXAZEPINE HYDROCHLORIDE

8-METHYL-2,3,4,5-TETRAHYDROPYRIDO[3,2-F][1,4]OXAZEPINE HYDROCHLORIDE

C9H13ClN2O (200.0716)


   

4-(dimethylammonio)piperidinium dichloride

4-(dimethylammonio)piperidinium dichloride

C7H18Cl2N2 (200.0847)


   

4-HYDROXY-4-METHOXYBIPHENYL

4-HYDROXY-4-METHOXYBIPHENYL

C13H12O2 (200.0837)


   

1-(TERT-BUTYL)-3-METHYL-1H-PYRAZOLE-5-CARBONYL CHLORIDE

1-(TERT-BUTYL)-3-METHYL-1H-PYRAZOLE-5-CARBONYL CHLORIDE

C9H13ClN2O (200.0716)


   

3-(Benzyloxy)phenol

3-(Benzyloxy)phenol

C13H12O2 (200.0837)


   

D-Phenylalaninamide hydrochloride

D-Phenylalaninamide hydrochloride

C9H13ClN2O (200.0716)


   

2-Naphthalenol,2-propanoate

2-Naphthalenol,2-propanoate

C13H12O2 (200.0837)


   

1H-Benzimidazol-2-amine,N-4H-1,2,4-triazol-4-yl-(9CI)

1H-Benzimidazol-2-amine,N-4H-1,2,4-triazol-4-yl-(9CI)

C9H8N6 (200.081)


   

(2,6-Difluoro-4-propylphenyl)boronic acid

(2,6-Difluoro-4-propylphenyl)boronic acid

C9H11BF2O2 (200.082)


   

1-naphthyl propionate

1-naphthyl propionate

C13H12O2 (200.0837)


   

1,2-Benzenedicarboxylicacid, ammonium salt (1:2)

1,2-Benzenedicarboxylicacid, ammonium salt (1:2)

C8H12N2O4 (200.0797)


   

2-Ethoxy-1-naphthaldehyde

2-Ethoxy-1-naphthaldehyde

C13H12O2 (200.0837)


   

phenoxymethoxybenzene

phenoxymethoxybenzene

C13H12O2 (200.0837)


   

Ethyl 2-oxo-2-(2-oxotetrahydro-2H-pyran-3-yl)acetate

Ethyl 2-oxo-2-(2-oxotetrahydro-2H-pyran-3-yl)acetate

C9H12O5 (200.0685)


   

UNII:07FN14F351

UNII:07FN14F351

C13H12O2 (200.0837)


   

n-tau-methyl-d3-histamine 2hcl

n-tau-methyl-d3-histamine 2hcl

C6H10Cl2D3N3 (200.0675)


   

2-(4-Piperidinyl)ethanamine dihydrochloride

2-(4-Piperidinyl)ethanamine dihydrochloride

C7H18Cl2N2 (200.0847)


   

2-Benzyloxyphenol

2-Benzyloxyphenol

C13H12O2 (200.0837)


   

3-(tert-butyl)-1-methyl-1H-pyrazole-5-carbonyl chloride

3-(tert-butyl)-1-methyl-1H-pyrazole-5-carbonyl chloride

C9H13ClN2O (200.0716)


   

2-(TERT-BUTYL)-6-(CHLOROMETHYL)PYRIMIDIN-4-OL

2-(TERT-BUTYL)-6-(CHLOROMETHYL)PYRIMIDIN-4-OL

C9H13ClN2O (200.0716)


   

Benzene,1-methoxy-2-phenoxy-

Benzene,1-methoxy-2-phenoxy-

C13H12O2 (200.0837)


   

6-chloro-n4,n4-diethylpyrimidine-2,4-diamine

6-chloro-n4,n4-diethylpyrimidine-2,4-diamine

C8H13ClN4 (200.0829)


   

(R)-(-)-GLYCIDYL1-NAPHTHYLETHER

(R)-(-)-GLYCIDYL1-NAPHTHYLETHER

C13H12O2 (200.0837)


   

1-[2-(5-methyl-2-furyl)phenyl]ethanone

1-[2-(5-methyl-2-furyl)phenyl]ethanone

C13H12O2 (200.0837)


   

S-(+)-α-Naphthyl Glycidyl Ether

S-(+)-α-Naphthyl Glycidyl Ether

C13H12O2 (200.0837)


   

ETHYL1-CYANOCYCLOPROPANECARBOXYLATE

ETHYL1-CYANOCYCLOPROPANECARBOXYLATE

C8H13ClN4 (200.0829)


   

Cyclohexyl 1,1,2,2-tetrafluoroethyl ether

Cyclohexyl 1,1,2,2-tetrafluoroethyl ether

C8H12F4O (200.0824)


   

2-cyclopropyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine

2-cyclopropyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine

C8H13ClN4 (200.0829)


   

2H-Pyrrolo[2,1-b][1,3]oxazine-6-carboxylicacid,3-aminohexahydro-4-oxo-(9CI)

2H-Pyrrolo[2,1-b][1,3]oxazine-6-carboxylicacid,3-aminohexahydro-4-oxo-(9CI)

C8H12N2O4 (200.0797)


   

Ethyl 2-hydroxy-4-(trimethylsilyl)-3-butynoate

Ethyl 2-hydroxy-4-(trimethylsilyl)-3-butynoate

C9H16O3Si (200.0869)


   

Benzene,1-methoxy-3-phenoxy-

Benzene,1-methoxy-3-phenoxy-

C13H12O2 (200.0837)


   

(2,5-DIOXO-1-PROPYL-IMIDAZOLIDIN-4-YL)-ACETIC ACID

(2,5-DIOXO-1-PROPYL-IMIDAZOLIDIN-4-YL)-ACETIC ACID

C8H12N2O4 (200.0797)


   

N,N-Dimethyl-3-piperidinamine dihydrochloride

N,N-Dimethyl-3-piperidinamine dihydrochloride

C7H18Cl2N2 (200.0847)


   

3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)propanoic acid

3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)propanoic acid

C8H12N2O4 (200.0797)


   

N-Methyl(1-Methylpyrrolidin-3-yl)Methanamine HCl

N-Methyl(1-Methylpyrrolidin-3-yl)Methanamine HCl

C7H18Cl2N2 (200.0847)


   

2-Ethoxybenzamidine hydrochloride

2-Ethoxybenzamidine hydrochloride

C9H13ClN2O (200.0716)


   

Acetamide,2-chloro-N-(1-cyanocyclohexyl)-

Acetamide,2-chloro-N-(1-cyanocyclohexyl)-

C9H13ClN2O (200.0716)


   

2-(4,4-Dimethyl-2,5-dioxo-imidazolidin-1-yl)-propionic acid

2-(4,4-Dimethyl-2,5-dioxo-imidazolidin-1-yl)-propionic acid

C8H12N2O4 (200.0797)


   

1H-Benzimidazol-1-amine,N-nitroso-N-2-propynyl-(9CI)

1H-Benzimidazol-1-amine,N-nitroso-N-2-propynyl-(9CI)

C10H8N4O (200.0698)


   

3,4-DI-O-ACETYL-D-XYLAL,

3,4-DI-O-ACETYL-D-XYLAL,

C9H12O5 (200.0685)


   

5-METHOXY-1-(2-METHOXYETHYL)-1H-PYRAZOLE-3-CARBOXYLIC ACID

5-METHOXY-1-(2-METHOXYETHYL)-1H-PYRAZOLE-3-CARBOXYLIC ACID

C8H12N2O4 (200.0797)


   

3-Phenoxy-propionamidine HCl

3-Phenoxy-propionamidine HCl

C9H13ClN2O (200.0716)


   

3-thio-4-amino-6-t-butyl-1,2,4-triazine-5-one

3-thio-4-amino-6-t-butyl-1,2,4-triazine-5-one

C7H12N4OS (200.0732)


   

4-benzylbenzene-1,3-diol

4-benzylbenzene-1,3-diol

C13H12O2 (200.0837)


   

3-[(2-amino-4-chlorophenyl)amino]propan-1-ol

3-[(2-amino-4-chlorophenyl)amino]propan-1-ol

C9H13ClN2O (200.0716)


   

[(3R)-1-methylpiperidin-3-yl]methanamine,dihydrochloride

[(3R)-1-methylpiperidin-3-yl]methanamine,dihydrochloride

C7H18Cl2N2 (200.0847)


   

1-Acetoxy-2-met hoxynaphthalene

1-Acetoxy-2-met hoxynaphthalene

C13H12O2 (200.0837)


   

(2-Phenoxyphenyl)methanol

(2-Phenoxyphenyl)methanol

C13H12O2 (200.0837)


   

3-(2-Naphthyl)propanoic acid

3-(2-Naphthyl)propanoic acid

C13H12O2 (200.0837)


   

N-[3-(AMINOMETHYL)PHENYL]ACETAMIDEHYDROCHLORIDE

N-[3-(AMINOMETHYL)PHENYL]ACETAMIDEHYDROCHLORIDE

C9H13ClN2O (200.0716)


   

N,N-Dimethyl(pyrrolidin-3-yl)Methanamine hydrochloride

N,N-Dimethyl(pyrrolidin-3-yl)Methanamine hydrochloride

C7H18Cl2N2 (200.0847)


   

6-chloro-2-N,2-N,4-N,4-N-tetramethylpyrimidine-2,4-diamine

6-chloro-2-N,2-N,4-N,4-N-tetramethylpyrimidine-2,4-diamine

C8H13ClN4 (200.0829)


   

1,2-Cyclopentanedicarboxylic acid, 4-oxo-, 1,2-dimethyl ester, (1R,2R)-

1,2-Cyclopentanedicarboxylic acid, 4-oxo-, 1,2-dimethyl ester, (1R,2R)-

C9H12O5 (200.0685)


   

1-(TERT-BUTYL)-5-METHYL-1H-PYRAZOLE-3-CARBONYL CHLORIDE

1-(TERT-BUTYL)-5-METHYL-1H-PYRAZOLE-3-CARBONYL CHLORIDE

C9H13ClN2O (200.0716)


   

[2,3-bipyridin]-6-ylboronic acid

[2,3-bipyridin]-6-ylboronic acid

C10H9BN2O2 (200.0757)


   

SODIUM P-T-BUTYLBENZOATE

SODIUM P-T-BUTYLBENZOATE

C11H13NaO2 (200.0813)


   

2-Naphthaleneacetic acid Methyl Ester

2-Naphthaleneacetic acid Methyl Ester

C13H12O2 (200.0837)


   

4-Amino-6-chloro-2-diethylaminopyrimidine

4-Amino-6-chloro-2-diethylaminopyrimidine

C8H13ClN4 (200.0829)


   

5-(ethoxymethylene)-2,2-dimethyl-1,3-dioxane-4,6-dione

5-(ethoxymethylene)-2,2-dimethyl-1,3-dioxane-4,6-dione

C9H12O5 (200.0685)


   

2,6,7-Trimethyl-1,4-naphthoquinone

2,6,7-Trimethyl-1,4-naphthoquinone

C13H12O2 (200.0837)


   

2-(2-Piperidinyl)ethanamine dihydrochloride

2-(2-Piperidinyl)ethanamine dihydrochloride

C7H18Cl2N2 (200.0847)


   

2-(3-Methoxyallylidene)malonic acid dimethyl ester, 95\\%

2-(3-Methoxyallylidene)malonic acid dimethyl ester, 95\\%

C9H12O5 (200.0685)


   

3,4-Di-O-acetyl-L-arabinal

3,4-Di-O-acetyl-L-arabinal

C9H12O5 (200.0685)


   

2-(1,2,3-Oxadiazol-4-ylmethyl)-1H-benzimidazole

2-(1,2,3-Oxadiazol-4-ylmethyl)-1H-benzimidazole

C10H8N4O (200.0698)


   

2-Trimethylsilanylethynyl-3-cyanopyridine

2-Trimethylsilanylethynyl-3-cyanopyridine

C11H12N2Si (200.077)


   

N,N-(1,2-DIHYDROXYETHYLENE)BISACRYLAMIDE

N,N-(1,2-DIHYDROXYETHYLENE)BISACRYLAMIDE

C8H12N2O4 (200.0797)


   

trans-1,2-di-(2-Thienyl)ethylene

trans-1,2-di-(2-Thienyl)ethylene

C10H16S2 (200.0693)


   

ETHYL 4-(TRIMETHYLSILYLOXY)-2-BUTYNOATE

ETHYL 4-(TRIMETHYLSILYLOXY)-2-BUTYNOATE

C9H16O3Si (200.0869)


   

1H-Benzimidazole-2-acetamide,alpha-cyano-(9CI)

1H-Benzimidazole-2-acetamide,alpha-cyano-(9CI)

C10H8N4O (200.0698)


   

2-Methyl-5-(1H-tetrazol-5-yl)-1H-benzimidazole

2-Methyl-5-(1H-tetrazol-5-yl)-1H-benzimidazole

C9H8N6 (200.081)


   

Benzene,1-methoxy-4-phenoxy-

Benzene,1-methoxy-4-phenoxy-

C13H12O2 (200.0837)


   

5-(4-METHOXY-PHENYL)-3H-[1,2,3]TRIAZOLE-4-CARBONITRILE

5-(4-METHOXY-PHENYL)-3H-[1,2,3]TRIAZOLE-4-CARBONITRILE

C10H8N4O (200.0698)


   

3-(chloromethyl)-5-cyclohexyl-1,2,4-oxadiazole

3-(chloromethyl)-5-cyclohexyl-1,2,4-oxadiazole

C9H13ClN2O (200.0716)


   

methyl 4-methyl-1-naphthoate

methyl 4-methyl-1-naphthoate

C13H12O2 (200.0837)


   

4,5-Pyrimidinediamine,N4-butyl-6-chloro-

4,5-Pyrimidinediamine,N4-butyl-6-chloro-

C8H13ClN4 (200.0829)


   

1-(7-METHOXY-NAPHTHALEN-2-YL)-ETHANONE

1-(7-METHOXY-NAPHTHALEN-2-YL)-ETHANONE

C13H12O2 (200.0837)


   

4-Deoxy-2,3-dihydromycosinol

2-(2,4-Hexadiynylidene)-1,6-dioxaspiro[4.4]non-3-ene

C13H12O2 (200.0837)


4-deoxy-2,3-dihydromycosinol is a member of the class of compounds known as ketals. Ketals are acetals derived from ketones by replacement of the oxo group by two hydrocarbyloxy groups R2C(OR)2 ( R not Hydrogen ). This term, once abandoned, has been reinstated as a subclass of acetals. 4-deoxy-2,3-dihydromycosinol is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). 4-deoxy-2,3-dihydromycosinol can be found in roman camomile, which makes 4-deoxy-2,3-dihydromycosinol a potential biomarker for the consumption of this food product.

   

3-amino-5H-pyrimido[5,4-b]indol-4-one

3-amino-5H-pyrimido[5,4-b]indol-4-one

C10H8N4O (200.0698)


   

4-(Dimethylamino)-3,5-difluorobenzamide

4-(Dimethylamino)-3,5-difluorobenzamide

C9H10F2N2O (200.0761)


   

4,6-dimethyl-2-(methylthio)-3a,6a-dihydro-1H-imidazo[4,5-d]imidazol-5-one

4,6-dimethyl-2-(methylthio)-3a,6a-dihydro-1H-imidazo[4,5-d]imidazol-5-one

C7H12N4OS (200.0732)


   

Tonghaosu, (Z)-

(7Z)-4-Deoxy-2,3-dihydromycosinol

C13H12O2 (200.0837)


(8Z)-8-Hexa-2,4-diynylidene-4,9-dioxaspiro[4.4]non-6-ene is a member of the class of compounds known as ketals. Ketals are acetals derived from ketones by replacement of the oxo group by two hydrocarbyloxy groups R2C(OR)2 ( R not Hydrogen ). This term, once abandoned, has been reinstated as a subclass of acetals (8Z)-8-Hexa-2,4-diynylidene-4,9-dioxaspiro[4.4]non-6-ene is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa).

   

Methyl N-acetyl allosamine

Methyl N-acetyl allosamine

C8H12N2O4 (200.0797)


   

Monobenzone

4-(Phenylmethoxy)phenol

C13H12O2 (200.0837)


D - Dermatologicals Same as: D05072

   
   

2-(5-Methyl-1H-benzimidazol-2(3H)-ylidene)-2-nitrosoacetonitrile

2-(5-Methyl-1H-benzimidazol-2(3H)-ylidene)-2-nitrosoacetonitrile

C10H8N4O (200.0698)


   

4-Phenyl-2-(2-oxopropyl)furan

4-Phenyl-2-(2-oxopropyl)furan

C13H12O2 (200.0837)


   

(3-Phenoxyphenyl)methanol

(3-Phenoxyphenyl)methanol

C13H12O2 (200.0837)


A member of the class of benzyl alcohols that is benzyl alcohol bearing a phenoxy substituent at C-3. It is a metbaolite of the insecticide permethrin.

   

Diamidafos

phenyl N,N-dimethylphosphorodiamidate

C8H13N2O2P (200.0715)


   

DEHYDROTREMETONE

Ethanone,1-[2-(1-methylethenyl)-5-benzofuranyl]-

C13H12O2 (200.0837)


   

(+)-(3S,4R)-3,4-dihydroxy-3,4-dihydrofluorene

(+)-(3S,4R)-3,4-dihydroxy-3,4-dihydrofluorene

C13H12O2 (200.0837)


   

3-(7-Oxo-1-aza-4-oxabicyclo(3.2.0)hept-3-yl)alanine

3-(7-Oxo-1-aza-4-oxabicyclo(3.2.0)hept-3-yl)alanine

C8H12N2O4 (200.0797)


D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D002969 - Clavulanic Acids D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams

   

Dihydroclavaminic acid

Dihydroclavaminic acid

C8H12N2O4 (200.0797)


   

dihydroclavaminic acid zwitterion

dihydroclavaminic acid zwitterion

C8H12N2O4 (200.0797)


Zwitterionic form of dihydroclavaminic acid.

   

bisphenol F

Bis(2-hydroxyphenyl)methane

C13H12O2 (200.0837)


   

3,6-Dihydro-4-(4-methyl-3-pentenyl)-1,2-dithiin

3,6-Dihydro-4-(4-methyl-3-pentenyl)-1,2-dithiin

C10H16S2 (200.0693)


   

Cyclo(Ala-Glu)

Cyclo(Ala-Glu)

C8H12N2O4 (200.0797)


   

3-(but-1-en-1-yl)isochromen-1-one

3-(but-1-en-1-yl)isochromen-1-one

C13H12O2 (200.0837)


   

(3s,7r,8as)-1,7-dihydroxy-3-(hydroxymethyl)-3h,6h,7h,8h,8ah-pyrrolo[1,2-a]pyrazin-4-one

(3s,7r,8as)-1,7-dihydroxy-3-(hydroxymethyl)-3h,6h,7h,8h,8ah-pyrrolo[1,2-a]pyrazin-4-one

C8H12N2O4 (200.0797)


   

6-(2-phenylethenyl)-5,6-dihydropyran-2-one

6-(2-phenylethenyl)-5,6-dihydropyran-2-one

C13H12O2 (200.0837)


   

4-hydroxy-6,6a-bis(hydroxymethyl)-3h,3ah,4h-cyclopenta[b]furan-2-one

4-hydroxy-6,6a-bis(hydroxymethyl)-3h,3ah,4h-cyclopenta[b]furan-2-one

C9H12O5 (200.0685)


   

methyl 2-[(1s,6s)-1,6-dihydroxy-4-oxocyclohex-2-en-1-yl]acetate

methyl 2-[(1s,6s)-1,6-dihydroxy-4-oxocyclohex-2-en-1-yl]acetate

C9H12O5 (200.0685)


   

2,4'-bisphenol f

2,4'-bisphenol f

C13H12O2 (200.0837)


   

methyl 2-(2-hydroxy-3,4-dimethyl-5-oxofuran-2-yl)acetate

methyl 2-(2-hydroxy-3,4-dimethyl-5-oxofuran-2-yl)acetate

C9H12O5 (200.0685)


   

4-methoxy-3-(3-methylbut-3-en-1-yn-1-yl)benzaldehyde

4-methoxy-3-(3-methylbut-3-en-1-yn-1-yl)benzaldehyde

C13H12O2 (200.0837)


   

(6s)-6-[(1e)-2-phenylethenyl]-5,6-dihydropyran-2-one

(6s)-6-[(1e)-2-phenylethenyl]-5,6-dihydropyran-2-one

C13H12O2 (200.0837)


   

2-(hexa-2,4-diyn-1-ylidene)-1,6-dioxaspiro[4,4]-non-3-ene

NA

C13H12O2 (200.0837)


{"Ingredient_id": "HBIN005672","Ingredient_name": "2-(hexa-2,4-diyn-1-ylidene)-1,6-dioxaspiro[4,4]-non-3-ene","Alias": "NA","Ingredient_formula": "C13H12O2","Ingredient_Smile": "CC#CC#CC=C1C=CC2(O1)CCCO2","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "9495","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

3-(1-butenyl)-1h-2-benzopyran-1-one,9ci; (e)-form

NA

C13H12O2 (200.0837)


{"Ingredient_id": "HBIN006974","Ingredient_name": "3-(1-butenyl)-1h-2-benzopyran-1-one,9ci; (e)-form","Alias": "NA","Ingredient_formula": "C13H12O2","Ingredient_Smile": "NA","Ingredient_weight": "200.23","OB_score": "NA","CAS_id": "29428-84-0","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8509","PubChem_id": "NA","DrugBank_id": "NA"}

   

7-hydroxy viteoid ii

NA

C9H12O5 (200.0685)


{"Ingredient_id": "HBIN013293","Ingredient_name": "7-hydroxy viteoid ii","Alias": "NA","Ingredient_formula": "C9H12O5","Ingredient_Smile": "C1COC(=O)C2=C(C(C(C21)O)O)CO","Ingredient_weight": "200.19 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10824","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "11095628","DrugBank_id": "NA"}

   

Ali diol

NA

C8H12N2O4 (200.0797)


{"Ingredient_id": "HBIN015128","Ingredient_name": "Ali diol","Alias": "NA","Ingredient_formula": "C8H12N2O4","Ingredient_Smile": "C=NC1=NC2C(C(C(C2O1)CO)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "39580","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

5-ethyl-3,4,5-trihydroxycyclohexa-1,3-diene-1-carboxylic acid

5-ethyl-3,4,5-trihydroxycyclohexa-1,3-diene-1-carboxylic acid

C9H12O5 (200.0685)


   

3-[2-(cyclohexa-2,4-dien-1-yl)ethenyl]pyran-2-one

3-[2-(cyclohexa-2,4-dien-1-yl)ethenyl]pyran-2-one

C13H12O2 (200.0837)


   

(1r,2r,4s,5r,6r,10s)-7-methyl-3,9-dioxatricyclo[4.4.0.0²,⁴]dec-7-ene-5,6,10-triol

(1r,2r,4s,5r,6r,10s)-7-methyl-3,9-dioxatricyclo[4.4.0.0²,⁴]dec-7-ene-5,6,10-triol

C9H12O5 (200.0685)


   

6-[(1e)-2-phenylethenyl]-5,6-dihydropyran-2-one

6-[(1e)-2-phenylethenyl]-5,6-dihydropyran-2-one

C13H12O2 (200.0837)


   

(3as,4r,6as)-4-hydroxy-6,6a-bis(hydroxymethyl)-3h,3ah,4h-cyclopenta[b]furan-2-one

(3as,4r,6as)-4-hydroxy-6,6a-bis(hydroxymethyl)-3h,3ah,4h-cyclopenta[b]furan-2-one

C9H12O5 (200.0685)


   

(4ar,5s,6r)-5,6-dihydroxy-7-(hydroxymethyl)-3h,4h,4ah,5h,6h-cyclopenta[c]pyran-1-one

(4ar,5s,6r)-5,6-dihydroxy-7-(hydroxymethyl)-3h,4h,4ah,5h,6h-cyclopenta[c]pyran-1-one

C9H12O5 (200.0685)


   

4,5-bis(hydroxymethyl)-6-methylbenzene-1,2,3-triol

4,5-bis(hydroxymethyl)-6-methylbenzene-1,2,3-triol

C9H12O5 (200.0685)


   

(8e)-9-(furan-2-yl)non-8-en-4,6-diyn-1-ol

(8e)-9-(furan-2-yl)non-8-en-4,6-diyn-1-ol

C13H12O2 (200.0837)


   

3-[(1e)-but-1-en-1-yl]isochromen-1-one

3-[(1e)-but-1-en-1-yl]isochromen-1-one

C13H12O2 (200.0837)


   

4a,5,6-trihydroxy-7-methyl-3h,4h,5h,6h-cyclopenta[c]pyran-1-one

4a,5,6-trihydroxy-7-methyl-3h,4h,5h,6h-cyclopenta[c]pyran-1-one

C9H12O5 (200.0685)


   

(2e,5r)-2-(hexa-2,4-diyn-1-ylidene)-1,6-dioxaspiro[4.4]non-3-ene

(2e,5r)-2-(hexa-2,4-diyn-1-ylidene)-1,6-dioxaspiro[4.4]non-3-ene

C13H12O2 (200.0837)


   

(2z,5s)-2-(hexa-2,4-diyn-1-ylidene)-1,6-dioxaspiro[4.4]non-3-ene

(2z,5s)-2-(hexa-2,4-diyn-1-ylidene)-1,6-dioxaspiro[4.4]non-3-ene

C13H12O2 (200.0837)


   

(2z,5r)-2-(hexa-2,4-diyn-1-ylidene)-1,6-dioxaspiro[4.4]non-3-ene

(2z,5r)-2-(hexa-2,4-diyn-1-ylidene)-1,6-dioxaspiro[4.4]non-3-ene

C13H12O2 (200.0837)


   

4-ethyl-3,4,5-trihydroxycyclohexa-1,5-diene-1-carboxylic acid

4-ethyl-3,4,5-trihydroxycyclohexa-1,5-diene-1-carboxylic acid

C9H12O5 (200.0685)


   

3-[(2r)-4-methoxy-6-oxo-2,3-dihydropyran-2-yl]propanoic acid

3-[(2r)-4-methoxy-6-oxo-2,3-dihydropyran-2-yl]propanoic acid

C9H12O5 (200.0685)


   

5-(1,2-dihydroxypropan-2-yl)-4-methoxypyran-2-one

5-(1,2-dihydroxypropan-2-yl)-4-methoxypyran-2-one

C9H12O5 (200.0685)


   

(3as,4s,6as)-4-hydroxy-6,6a-bis(hydroxymethyl)-3h,3ah,4h-cyclopenta[b]furan-2-one

(3as,4s,6as)-4-hydroxy-6,6a-bis(hydroxymethyl)-3h,3ah,4h-cyclopenta[b]furan-2-one

C9H12O5 (200.0685)


   

(1r,2r,4s,5r,6r,10r)-7-methyl-3,9-dioxatricyclo[4.4.0.0²,⁴]dec-7-ene-5,6,10-triol

(1r,2r,4s,5r,6r,10r)-7-methyl-3,9-dioxatricyclo[4.4.0.0²,⁴]dec-7-ene-5,6,10-triol

C9H12O5 (200.0685)


   

2-hydroxy-4-methoxy-3-methyl-2h,3h,3ah,7ah-furo[2,3-b]pyran-6-one

2-hydroxy-4-methoxy-3-methyl-2h,3h,3ah,7ah-furo[2,3-b]pyran-6-one

C9H12O5 (200.0685)


   

(2s)-2-amino-3-[(3s)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptan-3-yl]propanoic acid

(2s)-2-amino-3-[(3s)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptan-3-yl]propanoic acid

C8H12N2O4 (200.0797)


   

(2r)-7-phenylhepta-4,6-diyne-1,2-diol

(2r)-7-phenylhepta-4,6-diyne-1,2-diol

C13H12O2 (200.0837)


   

trideca-3,11-dien-5,7,9-triyne-1,2-diol

trideca-3,11-dien-5,7,9-triyne-1,2-diol

C13H12O2 (200.0837)


   

methyl 2-[(2s)-2-hydroxy-3,4-dimethyl-5-oxofuran-2-yl]acetate

methyl 2-[(2s)-2-hydroxy-3,4-dimethyl-5-oxofuran-2-yl]acetate

C9H12O5 (200.0685)


   

methyl 2-(1,6-dihydroxy-4-oxocyclohex-2-en-1-yl)acetate

methyl 2-(1,6-dihydroxy-4-oxocyclohex-2-en-1-yl)acetate

C9H12O5 (200.0685)


   

5,6-dihydroxy-7-(hydroxymethyl)-3h,4h,4ah,5h,6h-cyclopenta[c]pyran-1-one

5,6-dihydroxy-7-(hydroxymethyl)-3h,4h,4ah,5h,6h-cyclopenta[c]pyran-1-one

C9H12O5 (200.0685)


   

6-benzyl-4-methylpyran-2-one

6-benzyl-4-methylpyran-2-one

C13H12O2 (200.0837)


   

(2e,5s)-2-(hexa-2,4-diyn-1-ylidene)-1,6-dioxaspiro[4.4]non-3-ene

(2e,5s)-2-(hexa-2,4-diyn-1-ylidene)-1,6-dioxaspiro[4.4]non-3-ene

C13H12O2 (200.0837)


   

(4as,5r,6r)-4a,5,6-trihydroxy-7-methyl-3h,4h,5h,6h-cyclopenta[c]pyran-1-one

(4as,5r,6r)-4a,5,6-trihydroxy-7-methyl-3h,4h,5h,6h-cyclopenta[c]pyran-1-one

C9H12O5 (200.0685)


   

7-methyl-3,9-dioxatricyclo[4.4.0.0²,⁴]dec-7-ene-5,6,10-triol

7-methyl-3,9-dioxatricyclo[4.4.0.0²,⁴]dec-7-ene-5,6,10-triol

C9H12O5 (200.0685)