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
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 4ZUoTvu7R5k
Name 4-PHENYL-1-[(TRICHLOROMETHYL)THIO]-delta2-1,2,4-TRIAZOLIN-5-ONE
Source of Sample R. Rupprecht, W. Bremser BASF Ludwigshafen (1980)
CAS Registry Number 80240-20-6
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. 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
Molecular Weight 310.59
Solvent Dimethyl sulfoxide-d6; Reference=TMS; Temperature=Ambient Spectrometer= Bruker WP-80
Synonyms TRIAZOLIN-5-ONE, D<2-1,2,4-, 4-PHENYL-1-//TRICHLOROMETHYL/THIO/-,