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3-Penten-2-one, 1-(3-cyclohexen-1-yl)-4-methyl-, (.+-.)-
SpectraBase Compound ID IbowVeDUh1B
InChI InChI=1S/C12H18O/c1-10(2)8-12(13)9-11-6-4-3-5-7-11/h3-4,8,11H,5-7,9H2,1-2H3
InChIKey GPXVHDHYINGQPP-UHFFFAOYSA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1KRsEOiVMRh
Name 3-Penten-2-one, 1-(3-cyclohexen-1-yl)-4-methyl-, (.+-.)-
Alternate Name(s) 1-(3'-Cyclohexenyl)-4-methyl-3-penten-2-one 1-(3-cyclohexen-1-yl)-4-methyl-3-penten-2-one
CAS Registry Number 80872-02-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O
InChI InChI=1S/C12H18O/c1-10(2)8-12(13)9-11-6-4-3-5-7-11/h3-4,8,11H,5-7,9H2,1-2H3
InChIKey GPXVHDHYINGQPP-UHFFFAOYSA-N
Molecular Weight 178.275 g/mol
SMILES C(C(=O)CC1CC=CCC1)=C(C)C
SPLASH splash10-001j-9000000000-f6a157684fca09b71674
Source of Spectrum H-64-2201-0
Wiley ID 1174595