| SpectraBase Spectrum ID |
C4PbtsCPZoC |
| Name |
METHIDATHIONE |
| CAS Registry Number |
950-37-8 |
| 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 |
301.961857358 u |
| Formula |
C6H11N2O4PS3 |
| InChI |
InChI=1S/C6H11N2O4PS3/c1-10-5-7-8(6(9)16-5)4-15-13(14,11-2)12-3/h4H2,1-3H3 |
| InChIKey |
MEBQXILRKZHVCX-UHFFFAOYSA-N |
| Molecular Weight |
302.318 g/mol |
| Nominal Mass |
302 u |
| Number of Peaks |
73 |
| SMILES |
C1(=NN(C(=O)S1)CSP(OC)(OC)=S)OC |
| SPLASH |
splash10-000b-9800000000-e90c17e9d52af20c5d09 |
| Source of Spectrum |
Dr. Rolf Kuehnle |
| Synonyms |
S-[(5-methoxy-2-oxo-1,3,4-thiadiazol-3(2H)-yl)methyl] O,O-dimethyl dithiophosphate |
| Technique |
GC/MS |
| Wiley ID |
WID_MSPA_3427 |
