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(2E)-1-(rel-(1R,2S,6S)-2-Ethyl-6-methylcyclohex-3-enyl)but-2-en-1-one
SpectraBase Compound ID 3ZDzPGjSEZD
InChI InChI=1S/C13H20O/c1-4-7-12(14)13-10(3)8-6-9-11(13)5-2/h4,6-7,9-11,13H,5,8H2,1-3H3/b7-4+/t10-,11-,13+/m0/s1
InChIKey QWDVACJZZVJNPU-DAEQMPGYSA-N
Mol Weight 192.3 g/mol
Molecular Formula C13H20O
Exact Mass 192.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID iGSLZ7DuTI
Name (2E)-1-(rel-(1R,2S,6S)-2-Ethyl-6-methylcyclohex-3-enyl)but-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O
InChI InChI=1S/C13H20O/c1-4-7-12(14)13-10(3)8-6-9-11(13)5-2/h4,6-7,9-11,13H,5,8H2,1-3H3/b7-4+/t10-,11-,13+/m0/s1
InChIKey QWDVACJZZVJNPU-DAEQMPGYSA-N
Ionization Type EI
Molecular Weight 192.302 g/mol
SMILES C(C)[C@@]1([C@@]([C@](CC=C1)(C)[H])(C(\C=C\C)=O)[H])[H]
SPLASH splash10-03xu-9400000000-2c6160fa6c205f3a8fbc
Source of Spectrum US20100016197A1
Wiley ID 1842057