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

*Links on SpectraBase are not permalinks.
2-(4-Methylphenyl)-5-(phenylmethylidene)-[1,2,4]triazolo[3,2-B][1,3]thiazol-6-one
SpectraBase Compound ID Ir8ABblXYLj
InChI InChI=1S/C18H13N3OS/c1-12-7-9-14(10-8-12)16-19-18-21(20-16)17(22)15(23-18)11-13-5-3-2-4-6-13/h2-11H,1H3/b15-11-
InChIKey SFLLIWHECBVTCC-PTNGSMBKSA-N
Mol Weight 319.38 g/mol
Molecular Formula C18H13N3OS
Exact Mass 319.077933 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 EPSFJJJOY1E
Name 2-(4-Methylphenyl)-5-(phenylmethylidene)-[1,2,4]triazolo[3,2-B][1,3]thiazol-6-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 319.077933224 u
Formula C18H13N3OS
InChI InChI=1S/C18H13N3OS/c1-12-7-9-14(10-8-12)16-19-18-21(20-16)17(22)15(23-18)11-13-5-3-2-4-6-13/h2-11H,1H3/b15-11-
InChIKey SFLLIWHECBVTCC-PTNGSMBKSA-N
Molecular Weight 319.382 g/mol
SMILES C1(=NN2C(=O)\C(SC2=N1)=C\C1=CC=CC=C1)C1=CC=C(C)C=C1