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1H-Pyrrole-1-propanoic acid, 2,5-dihydro-3,4-dimethyl-2,5-dioxo-
SpectraBase Compound ID 2sYMHM0bXxF
InChI InChI=1S/C9H11NO4/c1-5-6(2)9(14)10(8(5)13)4-3-7(11)12/h3-4H2,1-2H3,(H,11,12)
InChIKey FBYUKWLOYLEBCO-UHFFFAOYSA-N
Mol Weight 197.19 g/mol
Molecular Formula C9H11NO4
Exact Mass 197.068808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID NLuPtycpU
Name 3-(2,5-diketo-3,4-dimethyl-3-pyrrolin-1-yl)propionic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H11NO4
InChI InChI=1S/C9H11NO4/c1-5-6(2)9(14)10(8(5)13)4-3-7(11)12/h3-4H2,1-2H3,(H,11,12)
InChIKey FBYUKWLOYLEBCO-UHFFFAOYSA-N
Molecular Weight 197.190 g/mol
SMILES OC(CCN1C(C(C)=C(C1=O)C)=O)=O
SPLASH splash10-0udr-4900000000-475cd984d898f32f88b4
Synonyms 3-(3,4-dimethyl-2,5-dioxo-1-pyrrolyl)propanoic acid 3-(3,4-Dimethyl-2,5-dioxo-2,5-dihydro-pyrrol-1-yl)-propionic acid 3-(3,4-dimethyl-2,5-dioxo-pyrrol-1-yl)propanoic acid 3-[3,4-dimethyl-2,5-bis(oxidanylidene)pyrrol-1-yl]propanoic acid
Wiley ID 1448764