| SpectraBase Spectrum ID |
5XkgNhPONxg |
| Name |
Thiopental-M 3ME |
| Classification |
Pharmaceutical drug metabolite |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| DEA Citation |
21 CFR §1308.13 (c) (3) |
| DEA Controlled Substance Form |
Any compound, mixture or preparation |
| DEA Controlled Substance Name |
Barbituric acid derivatives |
| DEA Controlled Substance Type |
Salts, isomers, derivatives and salts of isomers and derivatives |
| DEA Controlled Substances Code Number |
2100 |
| DEA Schedule |
Schedule III |
| DEA Section |
Depressants. Unless specifically excepted or unless listed in another schedule, any material, compound, mixture, or preparation which contains any quantity of the following substances having a depressant effect on the central nervous system |
| Exact Mass |
314.130028366 u |
| Formula |
C14H22N2O4S |
| InChI |
InChI=1S/C14H22N2O4S/c1-6-14(9(2)7-8-10(17)20-5)11(18)15(3)13(21)16(4)12(14)19/h9H,6-8H2,1-5H3 |
| InChIKey |
BEJVIZIXVKRDEN-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
314.400 g/mol |
| Nominal Mass |
314 u |
| Quality |
922 |
| Retention Index |
2324 |
| SMILES |
C1(C(N(C(N(C1=O)C)=S)C)=O)(C(CCC(OC)=O)C)CC |
| SPLASH |
splash10-114r-9640000000-a3f9263dd1771b820c5d |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
methyl 4-(5-ethyl-1,3-dimethyl-4,6-dioxo-2-thioxo-1,3-diazinan-5-yl)pentanoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_004028 |
