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4'-[(1'-Methyl-2-propyl-2',5-bi-1H-benzo[d]imidazole]-1-yl)methyl]biphenyl-2-carboxylic acid
SpectraBase Compound ID FgenbZPGLZq
InChI InChI=1S/C33H30N4O2/c1-3-4-13-31-34-28-20-24(32-35-27-11-7-8-12-29(27)36(32)2)18-19-30(28)37(31)21-22-14-16-23(17-15-22)25-9-5-6-10-26(25)33(38)39/h5-12,14-20H,3-4,13,21H2,1-2H3,(H,38,39)
InChIKey LJLLGJFODZRBLF-UHFFFAOYSA-N
Mol Weight 514.6 g/mol
Molecular Formula C33H30N4O2
Exact Mass 514.236876 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LydGOF7CGPk
Name 4'-[(1'-Methyl-2-propyl-2',5-bi-1H-benzo[d]imidazole]-1-yl)methyl]biphenyl-2-carboxylic acid
Alternate Name(s) 4'-((2'-butyl-1-methyl-1H,1'H-[2,5'-bibenzo[d]imidazol]-1'-yl)methyl)-[1,1'-biphenyl]-2-carboxylic acid 2-[4-[[2-butyl-5-(1-methyl-2-benzimidazolyl)-1-benzimidazolyl]methyl]phenyl]benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H30N4O2
InChI InChI=1S/C33H30N4O2/c1-3-4-13-31-34-28-20-24(32-35-27-11-7-8-12-29(27)36(32)2)18-19-30(28)37(31)21-22-14-16-23(17-15-22)25-9-5-6-10-26(25)33(38)39/h5-12,14-20H,3-4,13,21H2,1-2H3,(H,38,39)
InChIKey LJLLGJFODZRBLF-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cmdc.201200337
Molecular Weight 514.629 g/mol
SMILES OC(c1ccccc1-c1ccc(C[n]2c3ccc(-c4nc5c(cccc5)[n]4C)cc3nc2CCCC)cc1)=O
SPLASH splash10-0103-3320900000-0d129ac2e10749bcbfa7
Source of Spectrum CMC-7-1940-4_5
Wiley ID 1771784