For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
4-[[4-(4-PENTYLPHENYL)-1H-1,2,3-TRIAZOL-1-YL]-METHYL]-BENZOIC-ACID
SpectraBase Compound ID 1DIlKTElorZ
InChI InChI=1S/C21H23N3O2/c1-2-3-4-5-16-6-10-18(11-7-16)20-15-24(23-22-20)14-17-8-12-19(13-9-17)21(25)26/h6-13,15H,2-5,14H2,1H3,(H,25,26)
InChIKey FTSIRMIHTMNGFD-UHFFFAOYSA-N
Mol Weight 349.43 g/mol
Molecular Formula C21H23N3O2
Exact Mass 349.179027 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID AXvEKjshFEG
Name 4-[[4-(4-PENTYLPHENYL)-1H-1,2,3-TRIAZOL-1-YL]-METHYL]-BENZOIC-ACID
Compound Number 11O
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H23N3O2
InChI InChI=1S/C21H23N3O2/c1-2-3-4-5-16-6-10-18(11-7-16)20-15-24(23-22-20)14-17-8-12-19(13-9-17)21(25)26/h6-13,15H,2-5,14H2,1H3,(H,25,26)
InChIKey FTSIRMIHTMNGFD-UHFFFAOYSA-N
Literature Reference Author M.WROBEL,J.AUBE,B.KOENIG
Literature Reference Citation BEIL.J.ORG.CHEM.,8,1027(2012)
Literature Reference DOI 10.3762/bjoc.8.115
Molecular Weight 349.433 g/mol
Solvent DMSO-D6
Source File Reference UWIR10776