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3-[4'-Cyanophenyl]-1-(4"-methoxyphenyl)cyclohex-1-ene
SpectraBase Compound ID 3qT4lD2NCKL
InChI InChI=1S/C20H19NO/c1-22-20-11-9-17(10-12-20)19-4-2-3-18(13-19)16-7-5-15(14-21)6-8-16/h5-13,18H,2-4H2,1H3
InChIKey ODECUIPRBFTQQJ-UHFFFAOYSA-N
Mol Weight 289.38 g/mol
Molecular Formula C20H19NO
Exact Mass 289.146664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4Ltv5zrkKe
Name 3-[4'-Cyanophenyl]-1-(4"-methoxyphenyl)cyclohex-1-ene
Alternate Name(s) 3-[4'-Cyanophenyl]-1-(4''-methoxyphenyl)cyclohex-1-ene 4-[3-(4-methoxyphenyl)-2-cyclohexen-1-yl]benzonitrile
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Formula C20H19NO
InChI InChI=1S/C20H19NO/c1-22-20-11-9-17(10-12-20)19-4-2-3-18(13-19)16-7-5-15(14-21)6-8-16/h5-13,18H,2-4H2,1H3
InChIKey ODECUIPRBFTQQJ-UHFFFAOYSA-N
Molecular Weight 289.378 g/mol
SMILES C1=C(c2ccc(cc2)OC)CCCC1c1ccc(C#N)cc1
SPLASH splash10-000i-0290000000-3ef1477ea1bd33999963
Source of Spectrum OL-2001-48-5
Wiley ID 850183