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2'-(4-Butyl-1,2,3-triazol-1-yl)-4'-methylbiphenyl-4-carboxylic acid ethyl ester
SpectraBase Compound ID HdFNMWCjhCb
InChI InChI=1S/C22H25N3O2/c1-4-6-7-19-15-25(24-23-19)21-14-16(3)8-13-20(21)17-9-11-18(12-10-17)22(26)27-5-2/h8-15H,4-7H2,1-3H3
InChIKey CTCJIDRYBLSTBH-UHFFFAOYSA-N
Mol Weight 363.46 g/mol
Molecular Formula C22H25N3O2
Exact Mass 363.194677 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JIiS2OykGtv
Name 2'-(4-n-Butyl-1,2,3-triazol-1-yl)-4'-methylbiphenyl-4-carboxylic acid ethyl ester
Alternate Name(s) Ethyl 2'-(4-butyl-1H-1,2,3-triazol-1-yl)-4'-methyl-[1,1'-biphenyl]-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H25N3O2
InChI InChI=1S/C22H25N3O2/c1-4-6-7-19-15-25(24-23-19)21-14-16(3)8-13-20(21)17-9-11-18(12-10-17)22(26)27-5-2/h8-15H,4-7H2,1-3H3
InChIKey CTCJIDRYBLSTBH-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol9020354
Molecular Weight 363.461 g/mol
SMILES c1c(-[n]2cc(nn2)CCCC)c(ccc1C)-c1ccc(cc1)C(OCC)=O
SPLASH splash10-022c-0194000000-b7fdd9b713a91553f333
Source of Spectrum A1-11-4922/SMS7-3e
Wiley ID 1760119