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2-Methylcyclopentane-1,3-dione
SpectraBase Compound ID C398PUS1PbV
InChI InChI=1S/C6H8O2/c1-4-5(7)2-3-6(4)8/h4H,2-3H2,1H3
InChIKey HXZILEQYFQYQCE-UHFFFAOYSA-N
Mol Weight 112.13 g/mol
Molecular Formula C6H8O2
Exact Mass 112.052429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9du7QIvD4oI
Name 1,3-Cyclopentanedione, 2-methyl-
Alternate Name(s) 2-Methyl cyclopentane-1,3-dione 2-Methyl-1,3-cyclopentadione 2-Methyl-1,3-cyclopentanedione 2-Methylcyclopentane-1,3-quinone 3-Hydroxy-2-methyl-2-cyclopenten-1-one 3-Hydroxy-2-methyl-cyclopent-2-enone EINECS 212-153-2
CAS Registry Number 765-69-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H8O2
InChI InChI=1S/C6H8O2/c1-4-5(7)2-3-6(4)8/h4H,2-3H2,1H3
InChIKey HXZILEQYFQYQCE-UHFFFAOYSA-N
Molecular Weight 112.128 g/mol
SMILES CC1C(=O)CCC1=O
SPLASH splash10-08fr-9700000000-b3d0a2ac1d7671c43eb0
Source of Spectrum Va-0-0-0
Wiley ID 740714