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1-(3,5,5-trimethylcyclohex-2-en-1-ylidene)propan-2-one
SpectraBase Compound ID 4Kf5jzfrm1t
InChI InChI=1S/C12H18O/c1-9-5-11(6-10(2)13)8-12(3,4)7-9/h5-6H,7-8H2,1-4H3
InChIKey BPMFQXXZWSBLRP-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 BWtr6lVd4vY
Name 1-(3,5,5-trimethylcyclohex-2-en-1-ylidene)propan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O
InChI InChI=1S/C12H18O/c1-9-5-11(6-10(2)13)8-12(3,4)7-9/h5-6H,7-8H2,1-4H3
InChIKey BPMFQXXZWSBLRP-UHFFFAOYSA-N
Instrument Name Finnigan MAT-311A
Ionization Type EI
Molecular Weight 178.275 g/mol
SMILES CC1(C)CC(C=C(C1)C)=CC(=O)C
SPLASH splash10-03di-0900000000-9500af67c6704a511a91
Sample Comments E/Z mixture
Source of Spectrum US20140221682A1
Wiley ID 1849869