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Methyl (4-oxocyclohexylidene)acetate

View entire compound with spectra: 1 MS (GC)

Methyl (4-oxocyclohexylidene)acetate
SpectraBase Compound ID AVGUgnAvON3
InChI InChI=1S/C9H12O3/c1-12-9(11)6-7-2-4-8(10)5-3-7/h6H,2-5H2,1H3
InChIKey PAVUVUIRGAILNF-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 14XeFhoSS8
Name Methyl (4-oxocyclohexylidene)acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O3
InChI InChI=1S/C9H12O3/c1-12-9(11)6-7-2-4-8(10)5-3-7/h6H,2-5H2,1H3
InChIKey PAVUVUIRGAILNF-UHFFFAOYSA-N
Molecular Weight 168.192 g/mol
SMILES C(C(=O)OC)=C1CCC(CC1)=O
SPLASH splash10-0pxu-9400000000-e47982a7ff13ce60a053
Source of Spectrum Y4-82-55-20
Synonyms 2-(4-oxocyclohexylidene)acetic acid methyl ester Methyl 2-(4-oxocyclohexylidene)acetate Methyl 2-(4-oxidanylidenecyclohexylidene)ethanoate
Wiley ID 1513404