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4-Butoxy-4-methyl-2,5-cyclohexadienone

View entire compound with spectra: 1 MS (GC)

4-Butoxy-4-methyl-2,5-cyclohexadienone
SpectraBase Compound ID GSJW2r3NBkR
InChI InChI=1S/C11H16O3/c1-3-4-9-14-11(13-2)7-5-10(12)6-8-11/h5-8H,3-4,9H2,1-2H3
InChIKey XKPVCOQIUDJEHX-UHFFFAOYSA-N
Mol Weight 196.25 g/mol
Molecular Formula C11H16O3
Exact Mass 196.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KfA2HpLdoob
Name 4-Butoxy-4-methyl-2,5-cyclohexadienone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O3
InChI InChI=1S/C11H16O3/c1-3-4-9-14-11(13-2)7-5-10(12)6-8-11/h5-8H,3-4,9H2,1-2H3
InChIKey XKPVCOQIUDJEHX-UHFFFAOYSA-N
Molecular Weight 196.246 g/mol
SMILES C1(C=CC(C=C1)=O)(OC)OCCCC
SPLASH splash10-00di-1900000000-84a15f0d4e27b922e5cb
Source of Spectrum C-116-11688-34
Synonyms 4-Butoxy-4-methoxy-2,5-cyclohexadienone
Wiley ID 1193242