| SpectraBase Spectrum ID |
JGI4wYHo6fw |
| Name |
Clomethiazole-M (1-OH) TMS |
| Classification |
Pharmaceutical drug metabolite |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
249.041039547 u |
| Formula |
C9H16ClNOSSi |
| InChI |
InChI=1S/C9H16ClNOSSi/c1-7-9(13-6-11-7)8(5-10)12-14(2,3)4/h6,8H,5H2,1-4H3 |
| InChIKey |
KEAJEIDXOCJVHB-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
249.831 g/mol |
| Nominal Mass |
249 u |
| Quality |
726 |
| Retention Index |
1711 |
| SMILES |
C1(C(O[Si](C)(C)C)CCl)=C(N=CS1)C |
| SPLASH |
splash10-0udi-7290000000-bbc6355a25e38133b0e3 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
5-(2-chloro-1-((trimethylsilyl)oxy)ethyl)-4-methyl-1,3-thiazole |
| Technique |
GC/MS |
| Wiley ID |
DD2024_004521 |
