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3-(2-Oxo-2,3-dihydro-1H-benzimidazol-5-yl)butanoic acid
SpectraBase Compound ID HEpAczy1wcu
InChI InChI=1S/C11H12N2O3/c1-6(4-10(14)15)7-2-3-8-9(5-7)13-11(16)12-8/h2-3,5-6H,4H2,1H3,(H,14,15)(H2,12,13,16)
InChIKey CAWJUMGKCKILOK-UHFFFAOYSA-N
Mol Weight 220.23 g/mol
Molecular Formula C11H12N2O3
Exact Mass 220.084792 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IAwYI6UBGn8
Name 3-(2-Oxo-2,3-dihydro-1H-benzimidazol-5-yl)butanoic acid
Alternate Name(s) 3-(2-keto-1,3-dihydrobenzimidazol-5-yl)butyric acid 3-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)butanoic acid 3-(2-oxo-1,3-dihydrobenzimidazol-5-yl)butanoic acid 5-Benzimidazolinepropionic acid, .beta.-methyl-2-oxo- Butanoic acid, 3-(2,3-dihydro-2-oxobenzimidazol-5-yl)-
CAS Registry Number 21190-17-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12N2O3
InChI InChI=1S/C11H12N2O3/c1-6(4-10(14)15)7-2-3-8-9(5-7)13-11(16)12-8/h2-3,5-6H,4H2,1H3,(H,14,15)(H2,12,13,16)
InChIKey CAWJUMGKCKILOK-UHFFFAOYSA-N
Molecular Weight 220.228 g/mol
SMILES N1c2cc(C(CC(=O)O)C)ccc2NC1=O
SPLASH splash10-03di-5910000000-456fddc2ba368fd82275
Source of Spectrum AD-0-2532-0
Wiley ID 1419221