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(E)-(1S,2S)-trans-2-Phenylcyclopentyl 3,3-dimethylbut-1-enyl ketone
SpectraBase Compound ID LhhpAWJE3Cs
InChI InChI=1S/C18H24O/c1-18(2,3)13-12-17(19)16-11-7-10-15(16)14-8-5-4-6-9-14/h4-6,8-9,12-13,15-16H,7,10-11H2,1-3H3/b13-12-/t15-,16+/m1/s1
InChIKey LRRGHKVTRSWDHR-AXUOUDRWSA-N
Mol Weight 256.39 g/mol
Molecular Formula C18H24O
Exact Mass 256.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IijI91cbxMW
Name (E)-(1S,2S)-trans-2-Phenylcyclopentyl 3,3-dimethylbut-1-enyl ketone
Alternate Name(s) (2Z)-4,4-dimethyl-1-[(1S,2S)-2-phenylcyclopentyl]-2-penten-1-one
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Formula C18H24O
InChI InChI=1S/C18H24O/c1-18(2,3)13-12-17(19)16-11-7-10-15(16)14-8-5-4-6-9-14/h4-6,8-9,12-13,15-16H,7,10-11H2,1-3H3/b13-12-/t15-,16+/m1/s1
InChIKey LRRGHKVTRSWDHR-AXUOUDRWSA-N
Molecular Weight 256.389 g/mol
SMILES [C@@]1([C@@](c2ccccc2)(CCC1)[H])(C(\C=C/C(C)(C)C)=O)[H]
SPLASH splash10-03dm-5900000000-358555d6343b68775817
Source of Spectrum QC-4-68-17
Wiley ID 883231