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2-Cyclohexen-1-one, 3-(6-chloro-1,5-dimethyl-4-hexenyl)-, (E)-(.+-.)-
SpectraBase Compound ID Glmlht9V4rK
InChI InChI=1S/C14H21ClO/c1-11(10-15)5-3-6-12(2)13-7-4-8-14(16)9-13/h5,9,12H,3-4,6-8,10H2,1-2H3/b11-5+
InChIKey FDCHAVVLBFEEOL-VZUCSPMQSA-N
Mol Weight 240.77 g/mol
Molecular Formula C14H21ClO
Exact Mass 240.128093 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4zcFlqCKt2i
Name 2-Cyclohexen-1-one, 3-(6-chloro-1,5-dimethyl-4-hexenyl)-, (E)-(.+-.)-
CAS Registry Number 86678-44-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H21ClO
InChI InChI=1S/C14H21ClO/c1-11(10-15)5-3-6-12(2)13-7-4-8-14(16)9-13/h5,9,12H,3-4,6-8,10H2,1-2H3/b11-5+
InChIKey FDCHAVVLBFEEOL-VZUCSPMQSA-N
Molecular Weight 240.774 g/mol
SMILES C1(=CC(=O)CCC1)C(CC\C=C\(CCl)C)C
SPLASH splash10-0a5a-9300000000-505a4e26cf986c7b08d1
Source of Spectrum H-66-530-0
Synonyms 2-Cyclohexen-1-one, 3-(6-chloro-1,5-dimethyl-4-hexenyl)-, (Z)-(.+-.)- 1,6-(Chloroisopropylidenyl)-4-methylspiro[4.5]decan-7-one (isomer A) (E)-3-(6-chloro-1,5-dimethyl-4-hexenyl)-2-cyclohexenone (Z)-3-(6-chloro-1,5-dimethyl-4-hexyl)-2-cyclohexenone 3-[(4E)-6-chloro-1,5-dimethyl-4-hexenyl]-2-cyclohexen-1-one
Wiley ID 1243082