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

*Links on SpectraBase are not permalinks.

N-(2-butoxyphenyl)-2-[5-(4-methylsulfanylphenyl)-1,2,3,4-tetrazol-2-yl]ethanamide

View entire compound with spectra: 1 NMR, and 1 MS (GC)

N-(2-butoxyphenyl)-2-[5-(4-methylsulfanylphenyl)-1,2,3,4-tetrazol-2-yl]ethanamide
SpectraBase Compound ID FIs3W04s0Gi
InChI InChI=1S/C20H23N5O2S/c1-3-4-13-27-18-8-6-5-7-17(18)21-19(26)14-25-23-20(22-24-25)15-9-11-16(28-2)12-10-15/h5-12H,3-4,13-14H2,1-2H3,(H,21,26)
InChIKey WQCFUSFXUDVPEL-UHFFFAOYSA-N
Mol Weight 397.5 g/mol
Molecular Formula C20H23N5O2S
Exact Mass 397.157246 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

Subscribe to view the full spectrum.

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

SpectraBase Spectrum ID D7xghRmx29N
Name N-(2-Butoxyphenyl)-2-[5-(4-methylsulfanylphenyl)-1,2,3,4-tetrazol-2-yl]ethanamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 397.157246173 u
Formula C20H23N5O2S
InChI InChI=1S/C20H23N5O2S/c1-3-4-13-27-18-8-6-5-7-17(18)21-19(26)14-25-23-20(22-24-25)15-9-11-16(28-2)12-10-15/h5-12H,3-4,13-14H2,1-2H3,(H,21,26)
InChIKey WQCFUSFXUDVPEL-UHFFFAOYSA-N
Molecular Weight 397.497 g/mol
SMILES C=1C=CC(NC(CN2N=C(N=N2)C=2C=CC(SC)=CC2)=O)=C(OCCCC)C1