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trans-1,1-Dicyano-6-ethyl-4-methyl-2-phenylcyclohex-3-ene
SpectraBase Compound ID 5XORMrA0kvh
InChI InChI=1S/C17H18N2/c1-3-15-9-13(2)10-16(17(15,11-18)12-19)14-7-5-4-6-8-14/h4-8,10,15-16H,3,9H2,1-2H3/t15-,16+/m1/s1
InChIKey XYXQUROYMWTVAQ-CVEARBPZSA-N
Mol Weight 250.34 g/mol
Molecular Formula C17H18N2
Exact Mass 250.146999 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BIBuRECoDj0
Name trans-1,1-Dicyano-6-ethyl-4-methyl-2-phenylcyclohex-3-ene
Alternate Name(s) (2S,6R)-6-ethyl-4-methyl-2-phenyl-3-cyclohexene-1,1-dicarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18N2
InChI InChI=1S/C17H18N2/c1-3-15-9-13(2)10-16(17(15,11-18)12-19)14-7-5-4-6-8-14/h4-8,10,15-16H,3,9H2,1-2H3/t15-,16+/m1/s1
InChIKey XYXQUROYMWTVAQ-CVEARBPZSA-N
Molecular Weight 250.345 g/mol
SMILES C1([C@@](C=C(C[C@]1(CC)[H])C)(c1ccccc1)[H])(C#N)C#N
SPLASH splash10-002f-0900000000-a562826e996f245b53ad
Source of Spectrum QE-5-302-4
Wiley ID 843936