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(E)-3-(4-(Tert-butyl)phenyl)-2-(cyclohex-2-en-1-yl)acrylonitrile
SpectraBase Compound ID JKkbid3zYIv
InChI InChI=1S/C19H23N/c1-19(2,3)18-11-9-15(10-12-18)13-17(14-20)16-7-5-4-6-8-16/h5,7,9-13,16H,4,6,8H2,1-3H3/b17-13-
InChIKey XGOGXSZUSQLFDR-LGMDPLHJSA-N
Mol Weight 265.4 g/mol
Molecular Formula C19H23N
Exact Mass 265.18305 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AbZzNdxOmP5
Name (E)-3-(4-(Tert-butyl)phenyl)-2-(cyclohex-2-en-1-yl)acrylonitrile
Appearance Yellow oil
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Formula C19H23N
InChI InChI=1S/C19H23N/c1-19(2,3)18-11-9-15(10-12-18)13-17(14-20)16-7-5-4-6-8-16/h5,7,9-13,16H,4,6,8H2,1-3H3/b17-13-
InChIKey XGOGXSZUSQLFDR-LGMDPLHJSA-N
Instrument Name Finnigan MAT95Q/Finnigan MAT90
Ionization Type EI
Literature Reference DOI 10.1002/anie.202012085
Molecular Weight 265.400 g/mol
Reported Formula C19H23N
SMILES C(c1ccc(cc1)\C=C\(C#N)C1C=CCCC1)(C)(C)C
SPLASH splash10-066r-0940000000-0e3ca051c2cdc28ab1a6
Sample Comments E/Z = 99:1
Source of Spectrum ACI-60-SM24-7de
Wiley ID 1880410