Exact Mass: 180.0569

Exact Mass Matches: 180.0569

Found 43 metabolites which its exact mass value is equals to given mass value 180.0569, within given mass tolerance error 0.001 dalton. Try search metabolite list with more accurate mass tolerance error 0.0002 dalton.

9-Fluorenone

Fluoren-9-one

C13H8O (180.0575)


CONFIDENCE standard compound; INTERNAL_ID 11

   

Methionine sulfoximine

Butanoic acid, 2-amino-4-(S-methylsulfonimidoyl)- (9ci)

C5H12N2O3S (180.0569)


Methionine sulfoximine is found in flours treated with NCl3 as a produced of NCl3 action on wheat protein

   

METHIONINE SULFOXIMINE

(R-(R*,S*))-S-(3-Amino-3-carboxypropyl)-S-methylsulphoximide

C5H12N2O3S (180.0569)


A non-proteinogenic alpha-amino acid that is the sulfoximine derivative of methionine . KEIO_ID M114

   

12-Tridecene-4,6,8,10-tetraynal

tridec-12-en-4,6,8,10-tetraynal

C13H8O (180.0575)


12-Tridecene-4,6,8,10-tetraynal is found in green vegetables. 12-Tridecene-4,6,8,10-tetraynal is isolated from the roots of Silybum marianum (milk thistle). Isolated from the roots of Silybum marianum (milk thistle). 12-Tridecene-4,6,8,10-tetraynal is found in green vegetables.

   

2-Amino-4-(amino-methyl-oxo-lambda6-sulfanylidene)butanoic acid

2-Amino-4-(amino-methyl-oxo-lambda6-sulphanylidene)butanoic acid

C5H12N2O3S (180.0569)


   

1,2-Epoxide-1,11-Tridecadiene-3,5,7,9-tetrayne

1,2-Epoxide-1,11-Tridecadiene-3,5,7,9-tetrayne

C13H8O (180.0575)


   

(E)-7-Phenyl-2-heptene-4,6-diynal|(E)-7-phenylhept-2-ene-4,6-diynal|7-Phenyl-2-heptene-4,6-diynal|7-Phenyl-hept-2-en-4,6-diin-1-al

(E)-7-Phenyl-2-heptene-4,6-diynal|(E)-7-phenylhept-2-ene-4,6-diynal|7-Phenyl-2-heptene-4,6-diynal|7-Phenyl-hept-2-en-4,6-diin-1-al

C13H8O (180.0575)


   

Aldehyde-(E,E)-2,10,12-Tridecatriene-4,6,8-triyn-1-ol

Aldehyde-(E,E)-2,10,12-Tridecatriene-4,6,8-triyn-1-ol

C13H8O (180.0575)


   

11,12-Epoxide-1,11-Tridecadiene-3,5,7,9-tetrayne|2-dec-9-ene-1,3,5,7-tetraynyl-3-methyl-oxirane

11,12-Epoxide-1,11-Tridecadiene-3,5,7,9-tetrayne|2-dec-9-ene-1,3,5,7-tetraynyl-3-methyl-oxirane

C13H8O (180.0575)


   

1-Phenyl-heptatriin-(1,3,5)-ol-(1)|1-Phenyl-heptatriin-(1,3,5)-ol-(7)|7-Phenyl-2,4,6-heptatriyn-1-ol|7-phenyl-hepta-2,4,6-triyn-1-ol|7-Phenyl-heptatriin-(2,4,6)-ol-(1)

1-Phenyl-heptatriin-(1,3,5)-ol-(1)|1-Phenyl-heptatriin-(1,3,5)-ol-(7)|7-Phenyl-2,4,6-heptatriyn-1-ol|7-phenyl-hepta-2,4,6-triyn-1-ol|7-Phenyl-heptatriin-(2,4,6)-ol-(1)

C13H8O (180.0575)


   

(Z)-2-(1-Nonene-3,5,7-triynyl)furan

(Z)-2-(1-Nonene-3,5,7-triynyl)furan

C13H8O (180.0575)


   

2,12-Tridecadiene-4,6,8,10-tetrayne-1-ol

2,12-Tridecadiene-4,6,8,10-tetrayne-1-ol

C13H8O (180.0575)


   

12,13-Epoxi-tridecaen-(10)-tetrain-(2,4,6,8)|Tridecatetrain-(5,7,9,11)-en-(3)-epoxid-(1,2)|undec-1-ene-3,5,7,9-tetraynyl-oxirane

12,13-Epoxi-tridecaen-(10)-tetrain-(2,4,6,8)|Tridecatetrain-(5,7,9,11)-en-(3)-epoxid-(1,2)|undec-1-ene-3,5,7,9-tetraynyl-oxirane

C13H8O (180.0575)


   

L-Methionine sulfoximine

L-Methionine-DL-sulfoximine

C5H12N2O3S (180.0569)


A methionine sulfoximine in which the amino group has S-stereochemistry.

   

12-Tridecene-4,6,8,10-tetraynal

tridec-12-en-4,6,8,10-tetraynal

C13H8O (180.0575)


   

bis(2-chloroethoxy)-d8-methane

bis(2-chloroethoxy)-d8-methane

C5H2Cl2D8O2 (180.056)


   

(HYDROXYMETHYL)UREA

(HYDROXYMETHYL)UREA

C5H12N2O3S (180.0569)


   

phenalenone

phenalenone

C13H8O (180.0575)


   

Methionine sulfoximine zwitterion

Methionine sulfoximine zwitterion

C5H12N2O3S (180.0569)


   

(2S)-2-Amino-4-(methylsulfonimidoyl)butanoic acid

(2S)-2-Amino-4-(methylsulfonimidoyl)butanoic acid

C5H12N2O3S (180.0569)


   

(R-(R*,S*))-S-(3-Amino-3-carboxypropyl)-S-methylsulphoximide

(R-(R*,S*))-S-(3-Amino-3-carboxypropyl)-S-methylsulphoximide

C5H12N2O3S (180.0569)


   

(2S,5S)-methionine sulfoximine

(2S,5S)-methionine sulfoximine

C5H12N2O3S (180.0569)


   

(2S,5R)-methionine sulfoximine

(2S,5R)-methionine sulfoximine

C5H12N2O3S (180.0569)


   

Fluoren-9-one

Fluoren-9-one

C13H8O (180.0575)


The simplest member of the class fluoren-9-ones that is 9H-fluorene bearing an oxo substituent at position 9.

   

L-methionine sulfoximine zwitterion

L-methionine sulfoximine zwitterion

C5H12N2O3S (180.0569)


An L-alpha-amino acid zwitterion obtained by transfer of a proton from the carboxy to the amino group of L-methionine sulfoximine; major miscrospecies at pH 7.3.

   

perinaphthenone

perinaphthenone

C13H8O (180.0575)


   

2-(non-1-en-3,5,7-triyn-1-yl)furan

2-(non-1-en-3,5,7-triyn-1-yl)furan

C13H8O (180.0575)


   

(2e,10z)-trideca-2,10,12-trien-4,6,8-triynal

(2e,10z)-trideca-2,10,12-trien-4,6,8-triynal

C13H8O (180.0575)


   

2-(undec-9-en-1,3,5,7-tetrayn-1-yl)oxirane

2-(undec-9-en-1,3,5,7-tetrayn-1-yl)oxirane

C13H8O (180.0575)


   

2-(1-nonene-3,5,7-triynyl)furan

NA

C13H8O (180.0575)


{"Ingredient_id": "HBIN003586","Ingredient_name": "2-(1-nonene-3,5,7-triynyl)furan","Alias": "NA","Ingredient_formula": "C13H8O","Ingredient_Smile": "CC#CC#CC#CC=CC1=CC=CO1","Ingredient_weight": "180.2","OB_score": "NA","CAS_id": "2271-27-4","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9083","PubChem_id": "11446685","DrugBank_id": "NA"}

   

2-[(1e)-non-1-en-3,5,7-triyn-1-yl]furan

2-[(1e)-non-1-en-3,5,7-triyn-1-yl]furan

C13H8O (180.0575)


   

(2e)-trideca-2,12-dien-4,6,8,10-tetrayn-1-ol

(2e)-trideca-2,12-dien-4,6,8,10-tetrayn-1-ol

C13H8O (180.0575)


   

trideca-2,12-dien-4,6,8,10-tetrayn-1-ol

trideca-2,12-dien-4,6,8,10-tetrayn-1-ol

C13H8O (180.0575)


   

(2s,3s)-2-(dec-9-en-1,3,5,7-tetrayn-1-yl)-3-methyloxirane

(2s,3s)-2-(dec-9-en-1,3,5,7-tetrayn-1-yl)-3-methyloxirane

C13H8O (180.0575)


   

(2z,10z)-trideca-2,10,12-trien-4,6,8-triynal

(2z,10z)-trideca-2,10,12-trien-4,6,8-triynal

C13H8O (180.0575)


   

(2s)-2-[(9e)-undec-9-en-1,3,5,7-tetrayn-1-yl]oxirane

(2s)-2-[(9e)-undec-9-en-1,3,5,7-tetrayn-1-yl]oxirane

C13H8O (180.0575)


   

2-(undec-1-en-3,5,7,9-tetrayn-1-yl)oxirane

2-(undec-1-en-3,5,7,9-tetrayn-1-yl)oxirane

C13H8O (180.0575)


   

trideca-2,10,12-trien-4,6,8-triynal

trideca-2,10,12-trien-4,6,8-triynal

C13H8O (180.0575)


   

(2e,10e)-trideca-2,10,12-trien-4,6,8-triynal

(2e,10e)-trideca-2,10,12-trien-4,6,8-triynal

C13H8O (180.0575)


   

fluorenone

fluorenone

C13H8O (180.0575)


   

2-(dec-9-en-1,3,5,7-tetrayn-1-yl)-3-methyloxirane

2-(dec-9-en-1,3,5,7-tetrayn-1-yl)-3-methyloxirane

C13H8O (180.0575)


   

7-phenylhepta-2,4,6-triyn-1-ol

7-phenylhepta-2,4,6-triyn-1-ol

C13H8O (180.0575)


   

(2r)-2-[(1e)-undec-1-en-3,5,7,9-tetrayn-1-yl]oxirane

(2r)-2-[(1e)-undec-1-en-3,5,7,9-tetrayn-1-yl]oxirane

C13H8O (180.0575)