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1,2,4-Cyclopentanetrione, 3-methyl-
SpectraBase Compound ID 6wNiBlJ2pEC
InChI InChI=1S/C6H6O3/c1-3-4(7)2-5(8)6(3)9/h3H,2H2,1H3
InChIKey FUWXZDKUAHOVLL-UHFFFAOYSA-N
Mol Weight 126.11 g/mol
Molecular Formula C6H6O3
Exact Mass 126.031694 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2gm5mfVqgnH
Name 1,2,4-Cyclopentanetrione, 3-methyl-
CAS Registry Number 4505-54-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H6O3
InChI InChI=1S/C6H6O3/c1-3-4(7)2-5(8)6(3)9/h3H,2H2,1H3
InChIKey FUWXZDKUAHOVLL-UHFFFAOYSA-N
Molecular Weight 126.111 g/mol
SMILES CC1C(=O)C(=O)CC1=O
SPLASH splash10-057i-9400000000-d71f98d03082cb91fb48
Source of Spectrum O-6-683-1
Synonyms 3-Methyl-1,2,4-cyclopentanetrione 3-Methylcyclopentane-1,2,4-trione
Wiley ID 1129689