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

*Links on SpectraBase are not permalinks.

4-PHENYL-1-[(TRICHLOROMETHYL)THIO]-delta2-1,2,4-TRIAZOLIN-5-ONE

View entire compound with spectra: 5 NMR, and 2 FTIR

4-PHENYL-1-[(TRICHLOROMETHYL)THIO]-delta2-1,2,4-TRIAZOLIN-5-ONE
SpectraBase Compound ID 4KShEwpio1Y
InChI InChI=1S/C9H6Cl3N3OS/c10-9(11,12)17-15-8(16)14(6-13-15)7-4-2-1-3-5-7/h1-6H
InChIKey WRTRUXXMIXUFLY-UHFFFAOYSA-N
Mol Weight 310.59 g/mol
Molecular Formula C9H6Cl3N3OS
Exact Mass 308.929716 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 GqmicG1KcRL
Name 2-Trichloromethylthio-4-phenyl-2,4-dihydro-3H-1,2,4-triazolone-3
CAS Registry Number 80240-20-6
Comments WHE-6826-30
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H6Cl3N3OS
InChI InChI=1S/C9H6Cl3N3OS/c10-9(11,12)17-15-8(16)14(6-13-15)7-4-2-1-3-5-7/h1-6H
InChIKey WRTRUXXMIXUFLY-UHFFFAOYSA-N
Instrument Name Bruker WP-80
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6