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[(E,1S,3R)-5-cyclohexyl-1,3-dimethyl-pent-4-enyl]benzene
SpectraBase Compound ID T5MtBmLS5Q
InChI InChI=1S/C19H28/c1-16(13-14-18-9-5-3-6-10-18)15-17(2)19-11-7-4-8-12-19/h4,7-8,11-14,16-18H,3,5-6,9-10,15H2,1-2H3/b14-13+/t16-,17-/m0/s1
InChIKey CKJCMAKWJNHYGI-GAEQQSHZSA-N
Mol Weight 256.43 g/mol
Molecular Formula C19H28
Exact Mass 256.219101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GPtfNTZefOe
Name [(E,1S,3R)-5-cyclohexyl-1,3-dimethyl-pent-4-enyl]benzene
Appearance Colorless oil
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Formula C19H28
InChI InChI=1S/C19H28/c1-16(13-14-18-9-5-3-6-10-18)15-17(2)19-11-7-4-8-12-19/h4,7-8,11-14,16-18H,3,5-6,9-10,15H2,1-2H3/b14-13+/t16-,17-/m0/s1
InChIKey CKJCMAKWJNHYGI-GAEQQSHZSA-N
Instrument Name FINNIGAN MAT 95Q
Ionization Type EI
Literature Reference DOI 10.1002/anie.201910397
Molecular Weight 256.433 g/mol
Reported Formula C19H28
SMILES c1([C@](C[C@](\C=C\C2CCCCC2)(C)[H])(C)[H])ccccc1
SPLASH splash10-0aor-3900000000-3dd5762ed6e9d5c3f7e5
Sample Comments dr = 94:6
Source of Spectrum ACI-59-SM27-syn-6b
Wiley ID 1856766