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1-n-Octyl-4-phenyl-5-(2-tolyl)-1H-1,2,3-triazole

View entire compound with spectra: 1 MS (GC)

1-n-Octyl-4-phenyl-5-(2-tolyl)-1H-1,2,3-triazole
SpectraBase Compound ID AsSttiLdE1Z
InChI InChI=1S/C23H29N3/c1-3-4-5-6-7-13-18-26-23(21-17-12-11-14-19(21)2)22(24-25-26)20-15-9-8-10-16-20/h8-12,14-17H,3-7,13,18H2,1-2H3
InChIKey ZFRRTKLXLUNSCM-UHFFFAOYSA-N
Mol Weight 347.51 g/mol
Molecular Formula C23H29N3
Exact Mass 347.236148 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4CdOqYJppcw
Name 1-n-Octyl-4-phenyl-5-(2-tolyl)-1H-1,2,3-triazole
Alternate Name(s) 1-Octyl-4-phenyl-5-(o-tolyl)-1H-1,2,3-triazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H29N3
InChI InChI=1S/C23H29N3/c1-3-4-5-6-7-13-18-26-23(21-17-12-11-14-19(21)2)22(24-25-26)20-15-9-8-10-16-20/h8-12,14-17H,3-7,13,18H2,1-2H3
InChIKey ZFRRTKLXLUNSCM-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol801078r
Molecular Weight 347.506 g/mol
SMILES c1([n](nnc1-c1ccccc1)CCCCCCCC)-c1c(cccc1)C
SPLASH splash10-0a4j-1296000000-4f90e3e44be6b3281447
Source of Spectrum A1-10-3081/SMS7-4d
Wiley ID 1759603