| SpectraBase Spectrum ID |
2nZxUllkWBs |
| Name |
Cyclobarbitone |
| CAS Registry Number |
52-31-3 |
| Classification |
Pharmaceutical drug, hypnotic |
| Comments |
Spectrum verified by crosschecking against external libraries (five reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| 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 |
236.116092380 u |
| Formula |
C12H16N2O3 |
| InChI |
InChI=1S/C12H16N2O3/c1-2-12(8-6-4-3-5-7-8)9(15)13-11(17)14-10(12)16/h6H,2-5,7H2,1H3,(H2,13,14,15,16,17) |
| InChIKey |
WTYGAUXICFETTC-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
236.271 g/mol |
| Nominal Mass |
236 u |
| Quality |
993 |
| Retention Index |
1941 |
| SMILES |
C1(C(NC(NC1=O)=O)=O)(C1=CCCCC1)CC |
| SPLASH |
splash10-0a4i-9670000000-7695f15d34afac9bde53 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Cyclobarbital
5-(1-Cyclohexenyl)-5-ethyl-1,3-diazinane-2,4,6-trione |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000834 |
