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1-[2'-(4-n-Butyl-1,2,3-triazol-1-yl)-3'-methylbiphenyl-4-yl]-ethanone
SpectraBase Compound ID 1WQv2SGki3Y
InChI InChI=1S/C21H23N3O/c1-4-5-8-19-14-24(23-22-19)21-15(2)7-6-9-20(21)18-12-10-17(11-13-18)16(3)25/h6-7,9-14H,4-5,8H2,1-3H3
InChIKey VOSBQIAGRUGOGS-UHFFFAOYSA-N
Mol Weight 333.44 g/mol
Molecular Formula C21H23N3O
Exact Mass 333.184112 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9uZCn6hmCPF
Name 1-[2'-(4-n-Butyl-1,2,3-triazol-1-yl)-3'-methylbiphenyl-4-yl]-ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23N3O
InChI InChI=1S/C21H23N3O/c1-4-5-8-19-14-24(23-22-19)21-15(2)7-6-9-20(21)18-12-10-17(11-13-18)16(3)25/h6-7,9-14H,4-5,8H2,1-3H3
InChIKey VOSBQIAGRUGOGS-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol9020354
Molecular Weight 333.435 g/mol
SMILES c1(c(-[n]2nnc(c2)CCCC)c(-c2ccc(cc2)C(=O)C)ccc1)C
SPLASH splash10-00xr-1092000000-edf94162331d1a76ac2d
Source of Spectrum A1-11-4922/SMS7-3f
Synonyms 1-(2'-(4-butyl-1H-1,2,3-triazol-1-yl)-3'-methyl-[1,1'-biphenyl]-4-yl)ethanone
Wiley ID 1760120