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(2E)-1-(1,2-Dimethylcyclohex-3-enyl)but-2-en-1-one
SpectraBase Compound ID F7PFgXq8NUB
InChI InChI=1S/C12H18O/c1-4-7-11(13)12(3)9-6-5-8-10(12)2/h4-5,7-8,10H,6,9H2,1-3H3/b7-4+
InChIKey NXRJBULLTHYPFA-QPJJXVBHSA-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 J7Ley5Yqn8B
Name (2E)-1-(1,2-Dimethylcyclohex-3-enyl)but-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O
InChI InChI=1S/C12H18O/c1-4-7-11(13)12(3)9-6-5-8-10(12)2/h4-5,7-8,10H,6,9H2,1-3H3/b7-4+
InChIKey NXRJBULLTHYPFA-QPJJXVBHSA-N
Ionization Type EI
Molecular Weight 178.275 g/mol
SMILES CC1C(CCC=C1)(C)C(\C=C\C)=O
SPLASH splash10-066r-9300000000-d2061d04ad4fbcccbf60
Source of Spectrum US20100016197A1
Wiley ID 1842063