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

*Links on SpectraBase are not permalinks.

2-Trichloromethylmercapto-4-(4-fluoro-phenyl)-2,4-dihydro-1,2,4-triazolon-3

View entire compound with spectra: 4 NMR, and 2 FTIR

2-Trichloromethylmercapto-4-(4-fluoro-phenyl)-2,4-dihydro-1,2,4-triazolon-3
SpectraBase Compound ID MBTRFWox1L
InChI InChI=1S/C9H5Cl3FN3OS/c10-9(11,12)18-16-8(17)15(5-14-16)7-3-1-6(13)2-4-7/h1-5H
InChIKey HSRZKSYGWKPJBP-UHFFFAOYSA-N
Mol Weight 328.58 g/mol
Molecular Formula C9H5Cl3FN3OS
Exact Mass 326.920294 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 66gjPG9uIXp
Name 2-Trichloromethylmercapto-4-(4-fluoro-phenyl)-2,4-dihydro-1,2,4-triazolon-3
CAS Registry Number 80240-26-2
Comments WHE-6867-75
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H5Cl3FN3OS
InChI InChI=1S/C9H5Cl3FN3OS/c10-9(11,12)18-16-8(17)15(5-14-16)7-3-1-6(13)2-4-7/h1-5H
InChIKey HSRZKSYGWKPJBP-UHFFFAOYSA-N
Instrument Name Bruker WP-80
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3/DMSO-D6