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Cyclohexanecarbonitrile, 2-butyl-1-phenyl-, trans-
SpectraBase Compound ID 9dnqZ1rAdro
InChI InChI=1S/C17H23N/c1-2-3-9-15-12-7-8-13-17(15,14-18)16-10-5-4-6-11-16/h4-6,10-11,15H,2-3,7-9,12-13H2,1H3/t15-,17-/m1/s1
InChIKey ATXLXZHLSMKOTI-NVXWUHKLSA-N
Mol Weight 241.38 g/mol
Molecular Formula C17H23N
Exact Mass 241.18305 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AB64beTl4Nz
Name Cyclohexanecarbonitrile, 2-butyl-1-phenyl-, trans-
Alternate Name(s) (1R,2R)-2-butyl-1-phenylcyclohexanecarbonitrile trans 2-butyl 1-phenyl 1-cyclohexanecarbonitrile
CAS Registry Number 121926-44-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H23N
InChI InChI=1S/C17H23N/c1-2-3-9-15-12-7-8-13-17(15,14-18)16-10-5-4-6-11-16/h4-6,10-11,15H,2-3,7-9,12-13H2,1H3/t15-,17-/m1/s1
InChIKey ATXLXZHLSMKOTI-NVXWUHKLSA-N
Molecular Weight 241.378 g/mol
SMILES [C@]1(C#N)(c2ccccc2)[C@](CCCC)(CCCC1)[H]
SPLASH splash10-004l-1920000000-4da27516f61d69550c2e
Source of Spectrum I-67-564-78
Wiley ID 1244373