| SpectraBase Spectrum ID |
JHgYfDqC3pQ |
| Name |
Phenallymal |
| CAS Registry Number |
115-43-5 |
| Classification |
Pharmaceutical drug, hypnotic |
| Comments |
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 |
244.084792251 u |
| Formula |
C13H12N2O3 |
| InChI |
InChI=1S/C13H12N2O3/c1-2-8-13(9-6-4-3-5-7-9)10(16)14-12(18)15-11(13)17/h2-7H,1,8H2,(H2,14,15,16,17,18) |
| InChIKey |
WOIGZSBYKGQJGL-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
244.250 g/mol |
| Nominal Mass |
244 u |
| Quality |
933 |
| Retention Index |
2062 |
| SMILES |
C1(C(NC(NC1=O)=O)=O)(C1=CC=CC=C1)CC=C |
| SPLASH |
splash10-00ou-7960000000-ade019d6599ab1b085da |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
5-Allyl-5-phenylbarbituric acid
5-Phenyl-5-prop-2-enyl-1,3-diazinane-2,4,6-trione |
| Technique |
GC/MS |
| Wiley ID |
DD2024_011852 |
