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(+)-1-(p-Cyanobenzylidene)-2,3,:4,5:6,7,tribenzocyclohepta-2,4,6-triene
SpectraBase Compound ID LIlsWx6M90j
InChI InChI=1S/C27H17N/c28-18-20-15-13-19(14-16-20)17-27-25-11-5-3-9-23(25)21-7-1-2-8-22(21)24-10-4-6-12-26(24)27/h1-17H
InChIKey FHIJTWILYNOPRP-UHFFFAOYSA-N
Mol Weight 355.44 g/mol
Molecular Formula C27H17N
Exact Mass 355.1361 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CVzXI6vhq4N
Name (+)-1-(p-Cyanobenzylidene)-2,3,:4,5:6,7,tribenzocyclohepta-2,4,6-triene
Alternate Name(s) 4-(9H-tribenzo[a,c,e]cyclohepten-9-ylidenemethyl)benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H17N
InChI InChI=1S/C27H17N/c28-18-20-15-13-19(14-16-20)17-27-25-11-5-3-9-23(25)21-7-1-2-8-22(21)24-10-4-6-12-26(24)27/h1-17H
InChIKey FHIJTWILYNOPRP-UHFFFAOYSA-N
Molecular Weight 355.440 g/mol
SMILES C1(c2c(-c3ccccc3-c3c1cccc3)cccc2)=Cc1ccc(C#N)cc1
SPLASH splash10-0a4i-0119000000-a692e6a1bb24e5f78e45
Source of Spectrum J-58-4169-3
Wiley ID 1345433