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2,4',5-Trimethyl-3,3'-dicyano-5'-(4-methyl-3-cyanobenzyl)biphenylmethane
SpectraBase Compound ID Ja8wh4F91Lu
InChI InChI=1S/C27H23N3/c1-17-7-23(19(3)26(8-17)15-29)11-22-12-24(20(4)27(13-22)16-30)9-21-6-5-18(2)25(10-21)14-28/h5-8,10,12-13H,9,11H2,1-4H3
InChIKey JLMPVXBIHFWTPC-UHFFFAOYSA-N
Mol Weight 389.5 g/mol
Molecular Formula C27H23N3
Exact Mass 389.189198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1dShCi1Hyy
Name 2,4',5-Trimethyl-3,3'-dicyano-5'-(4-methyl-3-cyanobenzyl)biphenylmethane
Alternate Name(s) 3-[3-cyano-5-(3-cyano-4-methylbenzyl)-4-methylbenzyl]-2,5-dimethylbenzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H23N3
InChI InChI=1S/C27H23N3/c1-17-7-23(19(3)26(8-17)15-29)11-22-12-24(20(4)27(13-22)16-30)9-21-6-5-18(2)25(10-21)14-28/h5-8,10,12-13H,9,11H2,1-4H3
InChIKey JLMPVXBIHFWTPC-UHFFFAOYSA-N
Molecular Weight 389.502 g/mol
SMILES c1(c(c(C#N)cc(c1)C)C)Cc1cc(Cc2cc(C#N)c(cc2)C)c(c(c1)C#N)C
SPLASH splash10-0udi-1925000000-fd60a6f58634b48b7000
Source of Spectrum O1-32-1455-3
Wiley ID 819102