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3-Cyclohexene-1-butanal, .gamma.,4-dimethyl-2-oxo-
SpectraBase Compound ID Ctp9ZzYmyGw
InChI InChI=1S/C12H18O2/c1-9-5-6-11(12(14)8-9)10(2)4-3-7-13/h7-8,10-11H,3-6H2,1-2H3
InChIKey DCPNUWRTAZDIMB-UHFFFAOYSA-N
Mol Weight 194.27 g/mol
Molecular Formula C12H18O2
Exact Mass 194.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CCKAFOqgs34
Name 3-Cyclohexene-1-butanal, .gamma.,4-dimethyl-2-oxo-
CAS Registry Number 69494-13-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-9-5-6-11(12(14)8-9)10(2)4-3-7-13/h7-8,10-11H,3-6H2,1-2H3
InChIKey DCPNUWRTAZDIMB-UHFFFAOYSA-N
Molecular Weight 194.274 g/mol
SMILES C1(C=C(C)CCC1C(CCC=O)C)=O
SPLASH splash10-0006-1900000000-a4903f344aeb45aaf116
Source of Spectrum W5-14424-0-0
Synonyms 4-(4-Methyl-2-oxo-3-cyclohexen-1-yl)pentanal 4-(4-Methyl-2-oxo-1-cyclohex-3-enyl)pentanal 4-(4-Methyl-2-oxocyclohex-3-en-1-yl)pentanal 4-(4-Methyl-2-oxo-cyclohex-3-en-1-yl)pentanal 4-(4-Methyl-2-oxidanylidene-cyclohex-3-en-1-yl)pentanal
Wiley ID 1190960