SpectraBase Spectrum ID |
3RwKrVTRFxz |
Name |
FORMOTHIONE |
CAS Registry Number |
2540-82-1 |
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 |
256.994537212 u |
Formula |
C6H12NO4PS2 |
InChI |
InChI=1S/C6H12NO4PS2/c1-7(5-8)6(9)4-14-12(13,10-2)11-3/h5H,4H2,1-3H3 |
InChIKey |
AIKKULXCBHRFOS-UHFFFAOYSA-N |
Molecular Weight |
257.259 g/mol |
Nominal Mass |
257 u |
Number of Peaks |
82 |
SMILES |
C(SP(OC)(OC)=S)C(N(C=O)C)=O |
SPLASH |
splash10-004l-9600000000-d97175b9909e0d2b3400 |
Source of Spectrum |
Dr. Rolf Kuehnle |
Synonyms |
S-{2-[formyl(methyl)amino]-2-oxoethyl} O,O-dimethyl dithiophosphate |
Technique |
GC/MS |
Wiley ID |
WID_MSPA_3855 |