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3-Penten-2-one, 1-(3-cyclohexen-1-yl)-, (E)-(.+-.)-
SpectraBase Compound ID 1J9qytc1BeA
InChI InChI=1S/C11H16O/c1-2-6-11(12)9-10-7-4-3-5-8-10/h2-4,6,10H,5,7-9H2,1H3/b6-2+
InChIKey CCWDTRIDPQOLRY-QHHAFSJGSA-N
Mol Weight 164.25 g/mol
Molecular Formula C11H16O
Exact Mass 164.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2WNE1KOkMZ5
Name 3-Penten-2-one, 1-(3-cyclohexen-1-yl)-, (E)-(.+-.)-
Alternate Name(s) (3E)-1-(3-cyclohexen-1-yl)-3-penten-2-one (E)-1-(3'-cyclohexenyl)-3-penten-2-one
CAS Registry Number 80872-00-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O
InChI InChI=1S/C11H16O/c1-2-6-11(12)9-10-7-4-3-5-8-10/h2-4,6,10H,5,7-9H2,1H3/b6-2+
InChIKey CCWDTRIDPQOLRY-QHHAFSJGSA-N
Molecular Weight 164.248 g/mol
SMILES C(\C=C\C)(=O)CC1CC=CCC1
SPLASH splash10-003r-9000000000-9f16e6f007a72f214763
Source of Spectrum H-64-2201-0
Wiley ID 1160777