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2-(2-Nitro-phenyl)-7-oxo-3,5,7-triphenyl-hepta-2,4-diennitrile
SpectraBase Compound ID GhS30NaTRK5
InChI InChI=1S/C31H22N2O3/c32-22-28(27-18-10-11-19-29(27)33(35)36)31(25-16-8-3-9-17-25)26(23-12-4-1-5-13-23)20-21-30(34)24-14-6-2-7-15-24/h1-20H,21H2/b26-20+,31-28-
InChIKey YMZBCPIIMPSACT-ONAFMUSFSA-N
Mol Weight 470.53 g/mol
Molecular Formula C31H22N2O3
Exact Mass 470.163043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Yn4pXRE6TR
Name 2-(2-Nitro-phenyl)-7-oxo-3,5,7-triphenyl-hepta-2,4-diennitrile
Alternate Name(s) (2E,4E)-2-(2-nitrophenyl)-7-oxo-3,4,7-triphenylhepta-2,4-dienenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H22N2O3
InChI InChI=1S/C31H22N2O3/c32-22-28(27-18-10-11-19-29(27)33(35)36)31(25-16-8-3-9-17-25)26(23-12-4-1-5-13-23)20-21-30(34)24-14-6-2-7-15-24/h1-20H,21H2/b26-20+,31-28-
InChIKey YMZBCPIIMPSACT-ONAFMUSFSA-N
Literature Reference DOI 10.1002/prac.19933350417
Molecular Weight 470.528 g/mol
SMILES c1c(\C(C#N)=C/(\C(c2ccccc2)=C\CC(c2ccccc2)=O)c2ccccc2)c([N+](=O)[O-])ccc1
SPLASH splash10-08i0-9300000000-94ff898ff8b8351a5bbd
Source of Spectrum JF-335-393-3
Wiley ID 1789783