| SpectraBase Spectrum ID |
6ukQtIEaV0q |
| Name |
ATHIDATHIONE |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
329.993157487 u |
| Formula |
C8H15N2O4PS3 |
| InChI |
InChI=1S/C8H15N2O4PS3/c1-4-13-15(16,14-5-2)17-6-10-8(11)18-7(9-10)12-3/h4-6H2,1-3H3 |
| InChIKey |
QAOFKYGUSMPWNY-UHFFFAOYSA-N |
| Molecular Weight |
330.372 g/mol |
| Nominal Mass |
330 u |
| Number of Peaks |
98 |
| SMILES |
C1(SC(=NN1CSP(OCC)(OCC)=S)OC)=O |
| SPLASH |
splash10-000b-9600000000-253257c94369324f0c63 |
| Source of Spectrum |
Dr. Rolf Kuehnle |
| Synonyms |
O,O-diethyl S-[(5-methoxy-2-oxo-1,3,4-thiadiazol-3(2H)-yl)methyl] dithiophosphate |
| Technique |
GC/MS |
| Wiley ID |
WID_MSPA_4371 |
