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2'-(4-Butyl-1,2,3-triazol-1-yl)-4'-methylbiphenyl-3-carboxylic acid methyl ester
SpectraBase Compound ID KJJSQomaC2g
InChI InChI=1S/C21H23N3O2/c1-4-5-9-18-14-24(23-22-18)20-12-15(2)10-11-19(20)16-7-6-8-17(13-16)21(25)26-3/h6-8,10-14H,4-5,9H2,1-3H3
InChIKey RFTITQMDYPDTLN-UHFFFAOYSA-N
Mol Weight 349.43 g/mol
Molecular Formula C21H23N3O2
Exact Mass 349.179027 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HWEqpxxIhLX
Name 2'-(4-Butyl-1,2,3-triazol-1-yl)-4'-methylbiphenyl-3-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23N3O2
InChI InChI=1S/C21H23N3O2/c1-4-5-9-18-14-24(23-22-18)20-12-15(2)10-11-19(20)16-7-6-8-17(13-16)21(25)26-3/h6-8,10-14H,4-5,9H2,1-3H3
InChIKey RFTITQMDYPDTLN-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cssc.200900014
Molecular Weight 349.434 g/mol
SMILES c1[n](nnc1CCCC)-c1c(ccc(c1)C)-c1cc(ccc1)C(=O)OC
SPLASH splash10-00gi-0293000000-62d6d61235f02de88d48
Source of Spectrum CSC-2-546/SM14-6l
Synonyms Methyl 2'-(4-butyl-1H-1,2,3-triazol-1-yl)-4'-methyl-[1,1'-biphenyl]-3-carboxylate
Wiley ID 1787295