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

*Links on SpectraBase are not permalinks.
2-MERCAPTO-4-METHYL-delta2-1,3,4-THIADIAZOLIN-5-ONE,TRITHIOCARBONATE (2:1) (ESTER)
SpectraBase Compound ID GBjOIs9aNjd
InChI InChI=1S/C7H6N4O2S5/c1-10-5(12)15-3(8-10)17-7(14)18-4-9-11(2)6(13)16-4/h1-2H3
InChIKey KNJNJWQXEDDMKK-UHFFFAOYSA-N
Mol Weight 338.5 g/mol
Molecular Formula C7H6N4O2S5
Exact Mass 337.909431 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 IxpFLV5R7QO
Name 2-MERCAPTO-4-METHYL-delta2-1,3,4-THIADIAZOLIN-5-ONE,TRITHIOCARBONATE (2:1) (ESTER)
Source of Sample U. Anthoni, B. Mynster Dahl, H. Eggert Acta Chem. Scand. B 30, 71(1976)
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H6N4O2S5
InChI InChI=1S/C7H6N4O2S5/c1-10-5(12)15-3(8-10)17-7(14)18-4-9-11(2)6(13)16-4/h1-2H3
InChIKey KNJNJWQXEDDMKK-UHFFFAOYSA-N
Molecular Weight 338.47
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Bruker WH-90
Synonyms THIADIAZOLIN-5-ONE, D<2-1,3,4-, 2-MERCAPTO-4-METHYL-, TRITHIOCARBONATE /2 TO 1/ (ESTER)