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2-(4-maleimidophenyl)acetic acid
SpectraBase Compound ID AjnTCQnYoMG
InChI InChI=1S/C12H9NO4/c14-10-5-6-11(15)13(10)9-3-1-8(2-4-9)7-12(16)17/h1-6H,7H2,(H,16,17)
InChIKey KAZUDNXBQPEPGA-UHFFFAOYSA-N
Mol Weight 231.21 g/mol
Molecular Formula C12H9NO4
Exact Mass 231.053158 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AvqUYATbGkP
Name 2-(4-maleimidophenyl)acetic acid
Comments Less than 3 mono-isotopic peaks
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Formula C12H9NO4
InChI InChI=1S/C12H9NO4/c14-10-5-6-11(15)13(10)9-3-1-8(2-4-9)7-12(16)17/h1-6H,7H2,(H,16,17)
InChIKey KAZUDNXBQPEPGA-UHFFFAOYSA-N
Molecular Weight 231.207 g/mol
SMILES OC(Cc1ccc(N2C(C=CC2=O)=O)cc1)=O
SPLASH splash10-000i-0940000000-89b5a8ccd34d426b04eb
Source of Spectrum AH-128-97-7
Synonyms 2-[4-(2,5-dioxo-1-pyrrolyl)phenyl]acetic acid 2-[4-(2,5-dioxopyrrol-1-yl)phenyl]acetic acid 2-[4-[2,5-bis(oxidanylidene)pyrrol-1-yl]phenyl]ethanoic acid
Wiley ID 1232647