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(+)-(5S)-3-Vinyl-5-isopropenyl-2,4,4-trimethylcyclohex-2-enone
SpectraBase Compound ID EDVDfAuPzdO
InChI InChI=1S/C14H20O/c1-7-11-10(4)13(15)8-12(9(2)3)14(11,5)6/h7,12H,1-2,8H2,3-6H3/t12-/m0/s1
InChIKey WMWYBTGMIPTMGD-LBPRGKRZSA-N
Mol Weight 204.31 g/mol
Molecular Formula C14H20O
Exact Mass 204.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LlJdsRABTdZ
Name (+)-(5S)-3-Vinyl-5-isopropenyl-2,4,4-trimethylcyclohex-2-enone
Appearance Oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O
InChI InChI=1S/C14H20O/c1-7-11-10(4)13(15)8-12(9(2)3)14(11,5)6/h7,12H,1-2,8H2,3-6H3/t12-/m0/s1
InChIKey WMWYBTGMIPTMGD-LBPRGKRZSA-N
Instrument Name Jeol JMS-DX 303 GCMS
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0004.307
Molecular Weight 204.313 g/mol
Optical Rotation [a]D24 = 48.6 (c = 3.6, CHCl3)
Quality 147
SMILES C1(C(=C(C([C@@](C1)(C(=C)C)[H])(C)C)C=C)C)=O
SPLASH splash10-000l-2900000000-fd33647686d9d2f106f5
Source of Spectrum ARK-2003-63-23 (DOI: 10.3998/ark.5550190.0004.307)
Wiley ID 1899888