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1H-Pyrrole-2-carboxylic acid, 4-acetyl-3,5-dimethyl-, methyl ester
SpectraBase Compound ID LByTCqP2z9w
InChI InChI=1S/C10H13NO3/c1-5-8(7(3)12)6(2)11-9(5)10(13)14-4/h11H,1-4H3
InChIKey KCKRIDNULINGCM-UHFFFAOYSA-N
Mol Weight 195.22 g/mol
Molecular Formula C10H13NO3
Exact Mass 195.089543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JBF3bIVgNER
Name 1H-Pyrrole-2-carboxylic acid, 4-acetyl-3,5-dimethyl-, methyl ester
CAS Registry Number 89909-47-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H13NO3
InChI InChI=1S/C10H13NO3/c1-5-8(7(3)12)6(2)11-9(5)10(13)14-4/h11H,1-4H3
InChIKey KCKRIDNULINGCM-UHFFFAOYSA-N
Molecular Weight 195.218 g/mol
SMILES [nH]1c(c(c(c1C(=O)OC)C)C(=O)C)C
SPLASH splash10-0002-1900000000-7c8ee137ebf2d91a254d
Source of Spectrum JC-500-622-5
Synonyms 4-Acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid methyl ester 4-Acetyl-3,5-dimethyl-2-pyrrolecarboxylic acid, methyl ester Methyl 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylate Methyl 4-ethanoyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
Wiley ID 1192003