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1H-Pyrrole-3-acetic acid, 2,5-dihydro-4-methyl-2-oxo-
SpectraBase Compound ID 4rb7B1kNZdw
InChI InChI=1S/C7H9NO3/c1-4-3-8-7(11)5(4)2-6(9)10/h2-3H2,1H3,(H,8,11)(H,9,10)
InChIKey JXKPPRBGORFQKS-UHFFFAOYSA-N
Mol Weight 155.15 g/mol
Molecular Formula C7H9NO3
Exact Mass 155.058243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CV8877NJ5Iz
Name 1H-Pyrrole-3-acetic acid, 2,5-dihydro-4-methyl-2-oxo-
Alternate Name(s) 2-(3-Methyl-5-oxo-1,2-dihydropyrrol-4-yl)acetic acid 2-(3-Methyl-5-oxidanylidene-1,2-dihydropyrrol-4-yl)ethanoic acid
CAS Registry Number 66385-31-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H9NO3
InChI InChI=1S/C7H9NO3/c1-4-3-8-7(11)5(4)2-6(9)10/h2-3H2,1H3,(H,8,11)(H,9,10)
InChIKey JXKPPRBGORFQKS-UHFFFAOYSA-N
Molecular Weight 155.153 g/mol
SMILES N1CC(=C(CC(=O)O)C1=O)C
SPLASH splash10-0a4i-1900000000-ef89dc57ae918eee20b2
Source of Spectrum K-111-494-0
Wiley ID 1152659