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(3,4-Dimethyl-2-oxo-3-cyclopenten-1-yl)acetic acid
SpectraBase Compound ID K5Pyi9v2m1h
InChI InChI=1S/C9H12O3/c1-5-3-7(4-8(10)11)9(12)6(5)2/h7H,3-4H2,1-2H3,(H,10,11)
InChIKey TUALNYMHHCUUCY-UHFFFAOYSA-N
Mol Weight 168.19 g/mol
Molecular Formula C9H12O3
Exact Mass 168.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bx5sDyRlUma
Name (3,4-Dimethyl-2-oxo-3-cyclopenten-1-yl)acetic acid
CAS Registry Number 83663-23-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O3
InChI InChI=1S/C9H12O3/c1-5-3-7(4-8(10)11)9(12)6(5)2/h7H,3-4H2,1-2H3,(H,10,11)
InChIKey TUALNYMHHCUUCY-UHFFFAOYSA-N
Molecular Weight 168.192 g/mol
SMILES OC(CC1C(C(=C(C1)C)C)=O)=O
SPLASH splash10-05fr-5900000000-2a0fee501b9aaf136f1f
Source of Spectrum W5-1989-35105-30431
Synonyms 2-(2-keto-3,4-dimethyl-cyclopent-3-en-1-yl)acetic acid 2-(3,4-dimethyl-2-oxidanylidene-cyclopent-3-en-1-yl)ethanoic acid 2-(3,4-dimethyl-2-oxo-1-cyclopent-3-enyl)acetic acid 2-(3,4-dimethyl-2-oxo-cyclopent-3-en-1-yl)acetic acid 3,4-Dimethyl-2-oxocyclopent-3-enylacetic acid
Wiley ID 1164340