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1-(2,4-Dimethyl-1-(prop-1-en-2-yl)cyclohex-3-enyl)but-3-en-1-one
SpectraBase Compound ID 63ZjSPXSeTD
InChI InChI=1S/C15H22O/c1-6-7-14(16)15(11(2)3)9-8-12(4)10-13(15)5/h6,10,13H,1-2,7-9H2,3-5H3
InChIKey XEMDJTWRJXQQRA-UHFFFAOYSA-N
Mol Weight 218.34 g/mol
Molecular Formula C15H22O
Exact Mass 218.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 20HNoBUcZk
Name 1-(2,4-Dimethyl-1-(prop-1-en-2-yl)cyclohex-3-enyl)but-3-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O
InChI InChI=1S/C15H22O/c1-6-7-14(16)15(11(2)3)9-8-12(4)10-13(15)5/h6,10,13H,1-2,7-9H2,3-5H3
InChIKey XEMDJTWRJXQQRA-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 218.340 g/mol
SMILES C(C1(C(=O)CC=C)C(C=C(CC1)C)C)(=C)C
SPLASH splash10-0abd-3900000000-dbb82c5ee77f7b42b8af
Sample Comments Mixture of two isomers (8:2)
Source of Spectrum EP2188242A2
Wiley ID 1841841