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(3S,7R)-1-(8-Cyano-3,7-dimethyloctyl)-2,6,6-trimethyl-1-cyclohexene
SpectraBase Compound ID IxDMDg6seY7
InChI InChI=1S/C20H35N/c1-16(8-6-9-17(2)13-15-21)11-12-19-18(3)10-7-14-20(19,4)5/h16-17H,6-14H2,1-5H3/t16-,17+/m0/s1
InChIKey DKHWWEFLEZLSOH-DLBZAZTESA-N
Mol Weight 289.5 g/mol
Molecular Formula C20H35N
Exact Mass 289.27695 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8f41LmjoTJq
Name (3S,7R)-1-(8-Cyano-3,7-dimethyloctyl)-2,6,6-trimethyl-1-cyclohexene
Alternate Name(s) (3R,7S)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)nonanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H35N
InChI InChI=1S/C20H35N/c1-16(8-6-9-17(2)13-15-21)11-12-19-18(3)10-7-14-20(19,4)5/h16-17H,6-14H2,1-5H3/t16-,17+/m0/s1
InChIKey DKHWWEFLEZLSOH-DLBZAZTESA-N
Molecular Weight 289.507 g/mol
SMILES C1(=C(CCCC1(C)C)C)CC[C@](CCC[C@](CC#N)(C)[H])(C)[H]
SPLASH splash10-00di-3910000000-c7a3fc589651e0d54f8e
Source of Spectrum F-52-14900-20
Wiley ID 799774