Exact Mass: 96.0035

Exact Mass Matches: 96.0035

Found 91 metabolites which its exact mass value is equals to given mass value 96.0035, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Mesylate

Methanesulfonic acid solution

CH4SO3 (95.9881)


Mesylate, also known as methanesulfonate or mesylic acid, belongs to the class of organic compounds known as organosulfonic acids. Organosulfonic acids are compounds containing the sulfonic acid group, which has the general structure RS(=O)2OH (R is not a hydrogen atom). Mesylate exists as a solid, soluble (in water), and an extremely strong acidic compound (based on its pKa). Mesylate is also a parent compound for other transformation products, including but not limited to, methanesulfonates, S-methyl methanethiosulfonate, and (Z)-11-methyl-N-(methylsulfonyl)dodec-2-enamide. KEIO_ID M135 KEIO_ID M021

   

2-Furancarboxaldehyde

2-Furylaldehyde xypropane

C5H4O2 (96.0211)


2-furancarboxaldehyde, also known as furaldehyde or 2-formylfuran, is a member of the class of compounds known as aryl-aldehydes. Aryl-aldehydes are compounds containing an aldehyde group directly attached to an aromatic ring. 2-furancarboxaldehyde is soluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). 2-furancarboxaldehyde is a sweet, almond, and baked tasting compound and can be found in a number of food items such as coriander, cocoa bean, red raspberry, and rice, which makes 2-furancarboxaldehyde a potential biomarker for the consumption of these food products. 2-furancarboxaldehyde can be found primarily in feces and urine. 2-furancarboxaldehyde exists in all eukaryotes, ranging from yeast to humans. 2-Furancarboxaldehyde, also known as 2-furaldehyde or a-furole, belongs to the class of organic compounds known as aryl-aldehydes. Aryl-aldehydes are compounds containing an aldehyde group directly attached to an aromatic ring. 2-Furancarboxaldehyde is found in allspice and it is also a flavour ingredient. 2-Furancarboxaldehyde is present in coffee, calamus, matsutake mushroom (Tricholoma matsutake), pumpkin, malt, peated malt, Bourbon vanilla, Lambs lettuce, pimento leaf and various fruits, e.g. apple, apricot, sweet cherry, morello cherry, orange, grapefruit, Chinese quince and a common constituent of essential oils. Furfural is an organic compound derived from a variety of agricultural byproducts, including corncobs, oat, wheat bran, and sawdust.

   

Protoanemonin

5-methylidene-2,5-dihydrofuran-2-one

C5H4O2 (96.0211)


Protoanemonin (sometimes called anemonol or ranunculol) is a toxin found in all plants of the buttercup family (Ranunculaceae). On maceration, for example when the plant is wounded, it is produced by an enzymatic process from the glucoside ranunculin. It is the lactone of 4-hydroxy-2,4-pentadienoic acid. A wounded plant releases the substance, causing itch, rashes or blistering on contact with the skin or mucosa. (Wikipedia)

   

Fluorobenzene

Phenyl fluoride

C6H5F (96.0375)


   

Methylphosphonic acid

Dihydrogen methylphosphonate

CH5O3P (95.9976)


   

2-Chloroethane-1,1-diol

Chloroacetaldehyde hydrate

C2H5ClO2 (95.9978)


   

2-Hydroxypyrazine

1,2-Dihydropyrazin-2-one

C4H4N2O (96.0324)


   

2H-Pyran-2-one

5-Hydroxy-2,4-pentadienoic acid delta-lactone

C5H4O2 (96.0211)


   

3(2H)-Pyridazinone

3(2H)-Pyridazinone

C4H4N2O (96.0324)


   

5-Hydroxypyrimidine

5-hydroxypyrimidine

C4H4N2O (96.0324)


   

pyrimidin-2-ol

1,2-dihydropyrimidin-2-one

C4H4N2O (96.0324)


   

pyrimidin-4-ol

3,4-dihydropyrimidin-4-one

C4H4N2O (96.0324)


   

Sulfamide

Imidosulphamic acid

H4N2O2S (95.9993)


   

Sodium propionate

Sodium propionic acid anhydrous

C3H5NaO2 (96.0187)


Antimicrobial agent used in cheese and other foods

   

4H-PYRAN-4-ONE

4H-PYRAN-4-ONE

C5H4O2 (96.0211)


   

1,2,4-Triazin-3-amine

1,2,4-Triazin-3-amine

C3H4N4 (96.0436)


   

2-Pyrazinol

2-Hydroxypyrazine

C4H4N2O (96.0324)


   

4-Cyclopentene-1,3-dione

4-Cyclopentene-1,3-dione

C5H4O2 (96.0211)


   

2-Cyclopentene-1,4-dione

2-Cyclopentene-1,4-dione

C5H4O2 (96.0211)


   

Kieselsaeure

Silicon hydroxide (Si(OH)4)

H4O4Si (95.9879)


   

Hartshorn

Carbonic acid ammonium salt

CH8N2O3 (96.0535)


   

pyrimidone

2-Hydroxypyrimidine

C4H4N2O (96.0324)


   

sodium,propanoate

sodium,propanoate

C3H5NaO2 (96.0187)


   

PYRIDAZIN-4(1H)-ONE

PYRIDAZIN-4(1H)-ONE

C4H4N2O (96.0324)


   

Chloromethyl Methyl Sulfide

Chloromethyl Methyl Sulfide

C2H5ClS (95.98)


   

dimethyldifluorosilane

dimethyldifluorosilane

C2H6F2Si (96.0207)


   

ethylenediamine hydrochloride

ethylenediamine hydrochloride

C2H9ClN2 (96.0454)


   

1H-Pyrazole-3-carbaldehyde

1H-Pyrazole-3-carbaldehyde

C4H4N2O (96.0324)


   

3-METHYL-5-PYRAZOLONE

3-METHYL-5-PYRAZOLONE

C4H4N2O (96.0324)


   

5-hydroxypyrimidine

5-hydroxypyrimidine

C4H4N2O (96.0324)


   

2,2-Difluoro-1-propanol

2,2-Difluoro-1-propanol

C3H6F2O (96.0387)


   

3,3,3-Trifluoropropene

3,3,3-Trifluoropropene

C3H3F3 (96.0187)


   

1,1-DIMETHYLHYDRAZINE HYDROCHLORIDE

1,1-DIMETHYLHYDRAZINE HYDROCHLORIDE

C2H9ClN2 (96.0454)


   

1H-Imidazole-1-carbaldehyde

1H-Imidazole-1-carbaldehyde

C4H4N2O (96.0324)


   

4-Pyrimidinol

4-Hydroxypyrimidine

C4H4N2O (96.0324)


   

4-Pyridazinol

4-Pyridazinol

C4H4N2O (96.0324)


   

1,3-difluoro-2-propanol

1,3-difluoro-2-propanol

C3H6F2O (96.0387)


   

Ammonium carbonate

Ammonium carbonate

CH8N2O3 (96.0535)


   

2-chloro-2-fluoropropane

2-chloro-2-fluoropropane

C3H6ClF (96.0142)


   
   

Sodium propionate-13C3

Sodium propionate-13C3

C3H5NaO2 (96.0187)


   

1-VINYLTETRAZOLE

1-VINYLTETRAZOLE

C3H4N4 (96.0436)


   

lithium oxalate

lithium oxalate

C2HLiO4 (96.0035)


   

Difluoroacetic acid

Difluoroacetic acid

C2H2F2O2 (96.0023)


   

Fluoroacetyl chloride

Fluoroacetyl chloride

C2H2ClFO (95.9778)


   

lithium lactate

lithium lactate

C3H5LiO3 (96.0399)


   

1,3,5-Triazin-2-amine

2-Amino-1,3,5-triazine

C3H4N4 (96.0436)


   

sodium glyoxylate

sodium glyoxylate

C2HNaO3 (95.9823)


An organic sodium salt that is the monosodium salt of glyoxylic acid.

   

2-Aminoethylammonium chloride

2-Aminoethylammonium chloride

C2H9ClN2 (96.0454)


   

2-chloroethane-1,1-diol

2-chloroethane-1,1-diol

C2H5ClO2 (95.9978)


   

Algeldrate

Algeldrate

H5AlO4 (96.0003)


   

formaldehyde

formaldehyde

C3H5LiO3 (96.0399)


   

ethane-1,2-diamine,dihydrochloride

ethane-1,2-diamine,dihydrochloride

C2H9ClN2 (96.0454)


   

1H-Imidazole-4-carbaldehyde

1H-Imidazole-4-carbaldehyde

C4H4N2O (96.0324)


   

1H-Pyrazole-4-carbaldehyde

1H-Pyrazole-4-carbaldehyde

C4H4N2O (96.0324)


   

3-Furaldehyde

3-Furaldehyde

C5H4O2 (96.0211)


An aldehyde that is furan substituted by a formyl group at position 3. 3-Furaldehyde is a member of furans and an aldehyde, and can be used to synthesize the neoclerodane diterpene Salvinorin A[1][2]. 3-Furaldehyde is a member of furans and an aldehyde, and can be used to synthesize the neoclerodane diterpene Salvinorin A[1][2].

   

pyroligneous acid

pyroligneous acid

C5H4O2 (96.0211)


   

1-fluoro-3-chloropropane

1-fluoro-3-chloropropane

C3H6ClF (96.0142)


   

Pyrazine N-oxide

Pyrazine N-oxide

C4H4N2O (96.0324)


   

2-Acetlimidazole

2-Acetlimidazole

C4H4N2O (96.0324)


   

Pyridazine N-oxide

Pyridazine N-oxide

C4H4N2O (96.0324)


   

SULFAMIDE

SULFAMIDE

H4N2O2S (95.9993)


   

PYRIMIDINE 1-OXIDE

PYRIMIDINE 1-OXIDE

C4H4N2O (96.0324)


   

Ethylhydrazine hydrochloride (1:1)

Ethylhydrazine hydrochloride (1:1)

C2H9ClN2 (96.0454)


   

Dimethylchlorophosphine

Dimethylchlorophosphine

C2H6ClP (95.9896)


   

Lithium 2-hydroxypropanoate

Lithium 2-hydroxypropanoate

C3H5LiO3 (96.0399)


   

hydroxyazanium,nitrate

hydroxyazanium,nitrate

H4N2O4 (96.0171)


   

Algeldrate

Algeldrate

AlH5O4 (96.0003)


C29629 - Combination Medication > C29633 - Antacid Preparation

   

Sodium propionate

Sodium propionate

C3H5NaO2 (96.0187)


S - Sensory organs > S01 - Ophthalmologicals > S01A - Antiinfectives

   

Hydrogen phosphate

Hydrogen phosphate

HO4P-2 (95.9612)


   

Sulfamate

Sulfamate

H2NO3S- (95.9755)


D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals

   

2-Hydroxycyclopenta-2,4-dien-1-one

2-Hydroxycyclopenta-2,4-dien-1-one

C5H4O2 (96.0211)


   

Fural

5-17-09-00292 (Beilstein Handbook Reference)

C5H4O2 (96.0211)


   

498-60-2

InChI=1\C5H4O2\c6-3-5-1-2-7-4-5\h1-4

C5H4O2 (96.0211)


3-Furaldehyde is a member of furans and an aldehyde, and can be used to synthesize the neoclerodane diterpene Salvinorin A[1][2]. 3-Furaldehyde is a member of furans and an aldehyde, and can be used to synthesize the neoclerodane diterpene Salvinorin A[1][2].

   

c0298

cis-4-Methylenebut-2-en-4-olide

C5H4O2 (96.0211)


   

Pyridine N-oxide perchlorate

Pyridine N-oxide perchlorate

C5H6NO+ (96.0449)


   

CID 10313078

CID 10313078

AlH2NaOSi (95.9588)


   

Diaminozinc

Diaminozinc

H4N2Zn (95.9666)


   

CID 6857654

CID 6857654

HO4P- (95.9612)


   

CID 20491310

CID 20491310

HO4P (95.9612)


   

Methylphosphonic acid

Methylphosphonic acid

CH5O3P (95.9976)


   

Protoanemonin

Protoanemonin

C5H4O2 (96.0211)


   

2-Furaldehyde

2-Furaldehyde

C5H4O2 (96.0211)


An aldehyde that is furan with the hydrogen at position 2 substituted by a formyl group.

   

Methanesulfonate

METHANESULFONIC ACID

CH4SO3 (95.9881)


An alkanesulfonic acid in which the alkyl group directly linked to the sulfo functionality is methyl.

   

FLUOROBENZENE

FLUOROBENZENE

C6H5F (96.0375)


   

alpha-pyrone

2H-Pyran-2-one

C5H4O2 (96.0211)


   

OrthosilicicAcid

Orthosilicic acid

H4O4Si (95.9879)


   

hydroxidotrioxidophosphate(.1-)

hydroxidotrioxidophosphate(.1-)

HO4P (95.9612)


   

hydrogenphosphate

hydrogenphosphate

HO4P (95.9612)


A phosphate ion that is the conjugate base of dihydrogenphosphate.

   

Furancarboxaldehyde

Furancarboxaldehyde

C5H4O2 (96.0211)


   

anemonol

NA

C5H4O2 (96.0211)


{"Ingredient_id": "HBIN016069","Ingredient_name": "anemonol","Alias": "NA","Ingredient_formula": "C5H4O2","Ingredient_Smile": "C=C1C=CC(=O)O1","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT14294","TCMID_id": "1179","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}