Exact Mass: 91.9929714

Exact Mass Matches: 91.9929714

Found 72 metabolites which its exact mass value is equals to given mass value 91.9929714, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

mercaptoacetic acid

2-Mercaptoacetate, calcium salt (2:1) salt, trihydrate

C2H4O2S (91.9932004)


   

trans-3-Chloro-2-propene-1-ol

3-Chloroallyl alcohol, (Z)-isomer

C3H5ClO (92.00289100000002)


This compound belongs to the family of Primary Alcohols. These are compounds comprising the primary alcohol functional group, with the general strucuture RCOH (R=alkyl, aryl)

   

(Chloromethyl)oxirane

(RS)-3-Chloro-1,2-epoxypropane

C3H5ClO (92.00289100000002)


(Chloromethyl)oxirane is used for cross-linking dextrose units in food starc It is used for cross-linking dextrose units in food starch.

   

cis-3-Chloro-2-propene-1-ol

cis-3-Chloro-2-propene-1-ol

C3H5ClO (92.00289100000002)


This compound belongs to the family of Primary Alcohols. These are compounds comprising the primary alcohol functional group, with the general strucuture RCOH (R=alkyl, aryl)

   

Cyanosulfurous acid anion

dihydroxy-lambda3-sulfanecarbonitrile

CH2NO2S (91.9806252)


The OSCN- ion inhibits bacterial glyceraldehyde 3-P dehydrogenases (11, 24) and. thereby stops the bacterial production of acids from sugars. The inhibition of bacterial acid production by OSCN- has been implicated as playing an important role in the prevention of dental caries. Lactoperoxidase in the presence of thiocyanate detoxifies hydrogen peroxide by converting it into OSCN-, and OSCN- prevents bacteria from excreting hydrogen peroxide by inhibiting glyceraldehyde 3-P dehydrogenase. Because of this inhibition, no NADH is generated in the bacteria, and the hydrogen peroxide-producing NADH oxidases become short of their substrate, NADH. This inhibition of glycolysis usually has a bacteriostatic effect. In recent studies, significant levels of OSCN- have been found in saliva collected directly from the ducts of the salivary glands. This indicates that hydrogen peroxide is actually produced within the salivary glands; thus, lactoperoxidase and thiocyanate may also play an important role in protecting the salivary glands and ducts against hydrogen peroxide toxicity. The products of the lactoperoxidase-thiocyanate-hydrogen peroxide reaction have also been reported to be bactericidal. This effect has been ascribed to OSCN-, but it has also been suggested that higher oxyacids of the thiocyanate ion, cyanosulfurous and cyanosulfuric acids, may be formed in the lactoperoxidase reaction, and these acids may be the effective molecular species in the. killing. The OSCN- ion inhibits bacterial glyceraldehyde 3-P dehydrogenases (11, 24) and

   

Cibulins

propane-1-SO-thioperoxol

C3H8OS (92.0295838)


Cibulins is found in onion-family vegetables. Cibulins is isolated from onions inoculated with Botrytis cinerea and Fusarium solan

   

2-(Methylthio)ethanol

beta-Hydroxyethyl methyl sulphide

C3H8OS (92.0295838)


2-(Methylthio)ethanol, also known as 2-methylmercaptoethanol or 2-(methylsulfanyl)ethanol, belongs to the class of organic compounds known as dialkylthioethers. These are organosulfur compounds containing a thioether group that is substituted by two alkyl groups. 2-(Methylthio)ethanol is a meaty and sulfurous tasting compound. 2-(Methylthio)ethanol has been detected, but not quantified, in mung beans and soy beans. It is used as a food additive .

   
   

Hydroxymethyl hydrogen carbonate

Hydroxymethyl hydrogen carbonic acid

C2H4O4 (92.0109584)


   

Chloroacetone

Chloromethyl methyl ketone

C3H5ClO (92.00289100000002)


   
   

Hydroperoxyurea

N-Hydroperoxycarbamimidate

CH4N2O3 (92.0221914)


   

3-Chloroallyl alcohol

trans-3-Chloroallyl alcohol

C3H5ClO (92.00289100000002)


   

3-Mercapto-1-propanol

3-Mercapto-1-propanol

C3H8OS (92.0295838)


   

Dinitrile-2-Methylbutenedioic acid

Dinitrile-2-Methylbutenedioic acid

C5H4N2 (92.0374464)


   

1H-pyrrole-2-carbonitrile|2-cyano-pyrrol|2-cyanopyrrole|2-pyrrolecarbonitrile|2-pyrrolocarbonitrile|pyrrole 2-carbonitrile|pyrrole-2-carbonitrile

1H-pyrrole-2-carbonitrile|2-cyano-pyrrol|2-cyanopyrrole|2-pyrrolecarbonitrile|2-pyrrolocarbonitrile|pyrrole 2-carbonitrile|pyrrole-2-carbonitrile

C5H4N2 (92.0374464)


   
   

2,4-Hexadeynal

2,4-Hexadeynal

C6H4O (92.0262134)


   

Methyl fluoroacetate

Methyl fluoroacetate

C3H5FO2 (92.0273562)


   

Cibulins

propane-1-SO-thioperoxol

C3H8OS (92.0295838)


   

Methylthioethanol

beta-Hydroxyethyl methyl sulfide

C3H8OS (92.0295838)


   

2-Methoxyethanethiol

2-Methoxyethanethiol

C3H8OS (92.0295838)


   

Silicic acid, methyl ester

Silicic acid, methyl ester

CH4O3Si (91.9929714)


   

3-Fluoropropanoic acid

3-Fluoropropanoic acid

C3H5FO2 (92.0273562)


   

(S)-Epichlorohydrin

(S)-(+)-Epichlorhydrin

C3H5ClO (92.00289100000002)


   

Chlorobutane

N-butyl Chloride

C4H9Cl (92.03927440000001)


C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C250 - Antihelminthic Agent

   
   

1-Fluoro-3-hydroxy-2-propanone

1-Fluoro-3-hydroxy-2-propanone

C3H5FO2 (92.0273562)


   
   

(2H4)-1,3-Dioxolan-2-one

(2H4)-1,3-Dioxolan-2-one

C3D4O3 (92.041152112)


   
   

Poly(oxy-1,3-phenylene)(9CI)

Poly(oxy-1,3-phenylene)(9CI)

C6H4O (92.0262134)


   

1H-Pyrrole-3-carbonitrile

1H-Pyrrole-3-carbonitrile

C5H4N2 (92.0374464)


   

4-Ethynyl-1H-pyrazole

4-Ethynyl-1H-pyrazole

C5H4N2 (92.0374464)


   

2-Oxoacetic acid

2-Oxoacetic acid

C2H4O4 (92.0109584)


2,2-Dihydroxyacetic acid is an endogenous metabolite.

   

tert-butyl chloride

2-Chloro-2-methylpropane

C4H9Cl (92.03927440000001)


   
   
   
   

dimethylsilanediol

POLY(DIMETHYLSILOXANE), HYDROXY TERMINATED

C2H8O2Si (92.02935480000001)


   

Aminoacetonitrile hydrochloride

Aminoacetonitrile hydrochloride

C2H5ClN2 (92.014124)


   
   
   

trifluorochlorine

Chlorine trifluoride

ClF3 (91.9640626)


D020011 - Protective Agents > D002327 - Cariostatic Agents > D005459 - Fluorides

   

calcium cyanide

calcium cyanide

C2CaN2 (91.968739)


   

2-Fluoropropionic acid

2-Fluoropropionic acid

C3H5FO2 (92.0273562)


   

nitrogen dioxide

Dinitrogen tetroxide

N2O4 (91.985808)


   

1-sulfanylpropan-2-ol

1-sulfanylpropan-2-ol

C3H8OS (92.0295838)


   

glyoxylic acid hydrate

glyoxylic acid hydrate

C2H4O4 (92.0109584)


   

Pyrrole-2-carbonitrile

Pyrrole-2-carbonitrile

C5H4N2 (92.0374464)


   

dimethylaluminum chloride

dimethylaluminum chloride

C2H6AlCl (91.9973416)


   

disilicon tricarbide

disilicon tricarbide

C3Si2 (91.953856)


   

3-ETHYNYL-FURAN

3-ETHYNYL-FURAN

C6H4O (92.0262134)


   

Chlorine trifluoride

Chlorine trifluoride

ClF3 (91.9640626)


   

3-ETHYNYL-2-HYDROXY-PHENOL

3-ETHYNYL-2-HYDROXY-PHENOL

C6H4O (92.0262134)


   

Trimethylphosphine Oxide

Trimethylphosphine Oxide

C3H9OP (92.0390994)


   
   

Disulfur dinitride

Disulfur dinitride

N2S2 (91.950292)


   

Hydroxymethylnitramine

Hydroxymethylnitramine

CH4N2O3 (92.0221914)


   

Dithiocarbamate

Dithiocarbamate

CH2NS2- (91.9628672)


   

1,2-Dinitrosodioxidane

1,2-Dinitrosodioxidane

N2O4 (91.985808)


   

Hydroperoxyacetic acid

Hydroperoxyacetic acid

C2H4O4 (92.0109584)


   

Thioglycolic acid

mercaptoacetic acid

C2H4O2S (91.9932004)


   

trans-3-Chloroallyl alcohol

trans-3-Chloroallyl alcohol

C3H5ClO (92.00289100000002)


   
   
   

2-METHYLTHIOETHANOL

2-(Methylthio)ethanol

C3H8OS (92.0295838)


A primary alcohol that is the S-methyl derivative of mercaptoethanol. It is found as a volatile component in Cucumis melo Var. cantalupensis.

   
   

propanesulfenic acid

propanesulfenic acid

C3H8OS (92.0295838)


An S-alkylsulfenic acid that is sulfenic acid in which the thiol hydrogen is replaced by a propyl group.

   

trans-3-chloroprop-2-en-1-ol

trans-3-chloroprop-2-en-1-ol

C3H5ClO (92.00289100000002)


   
   

2,4-hexadiynal

NA

C6H4O (92.0262134)


{"Ingredient_id": "HBIN004395","Ingredient_name": "2,4-hexadiynal","Alias": "NA","Ingredient_formula": "C6H4O","Ingredient_Smile": "CC#CC#CC=O","Ingredient_weight": "92.1","OB_score": "NA","CAS_id": "3777-60-4","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8886","PubChem_id": "17877642","DrugBank_id": "NA"}