| SpectraBase Spectrum ID |
2oDpwxdCFP6 |
| Name |
Methyl methanethiosulfonate |
| CAS Registry Number |
2949-92-0 |
| Classification |
Flavor |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
125.980921779 u |
| Formula |
C2H6O2S2 |
| InChI |
InChI=1S/C2H6O2S2/c1-5-6(2,3)4/h1-2H3 |
| InChIKey |
XYONNSVDNIRXKZ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
126.188 g/mol |
| Nominal Mass |
126 u |
| Quality |
947 |
| Retention Index |
1024 |
| SMILES |
CSS(=O)(=O)C |
| SPLASH |
splash10-0002-9000000000-ff9150a29e6096a5030e |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Methanethiosulfonic acid S-methyl ester
Methylsulfonylsulfanylmethane |
| Technique |
GC/MS |
| Wiley ID |
DD2024_010461 |
