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trans-1,1-Dicyano-4,6-dimethyl-2-phenylcyclohex-3-ene
SpectraBase Compound ID JWjOl2Dmc4a
InChI InChI=1S/C16H16N2/c1-12-8-13(2)16(10-17,11-18)15(9-12)14-6-4-3-5-7-14/h3-7,9,13,15H,8H2,1-2H3/t13-,15+/m1/s1
InChIKey NHHVEHKSLRGDQD-HIFRSBDPSA-N
Mol Weight 236.32 g/mol
Molecular Formula C16H16N2
Exact Mass 236.131349 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DUWwnlyEm35
Name trans-1,1-Dicyano-4,6-dimethyl-2-phenylcyclohex-3-ene
Alternate Name(s) (2S,6R)-4,6-dimethyl-2-phenyl-3-cyclohexene-1,1-dicarbonitrile
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Formula C16H16N2
InChI InChI=1S/C16H16N2/c1-12-8-13(2)16(10-17,11-18)15(9-12)14-6-4-3-5-7-14/h3-7,9,13,15H,8H2,1-2H3/t13-,15+/m1/s1
InChIKey NHHVEHKSLRGDQD-HIFRSBDPSA-N
Molecular Weight 236.318 g/mol
SMILES C1([C@@](C=C(C[C@]1(C)[H])C)(c1ccccc1)[H])(C#N)C#N
SPLASH splash10-004l-0900000000-bb5eb0ee7e827fa84251
Source of Spectrum QE-5-301-4
Wiley ID 843938