| SpectraBase Spectrum ID |
B1UCuvL4msS |
| Name |
Dienedione |
| CAS Registry Number |
5173-46-6 |
| Classification |
Pharmaceutical drug, anabolic-androgenic steroid (AAS) |
| Comments |
Spectrum verified by crosschecking against external libraries (one 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 (f) (69) |
| DEA Controlled Substance Name |
19-nor-4,9(10)-androstadienedione |
| DEA Controlled Substance Type |
Salts, esters and ethers |
| DEA Controlled Substances Code Number |
4000 |
| DEA Schedule |
Schedule III |
| DEA Section |
Anabolic Steroids. Unless specifically excepted or unless listed in another schedule, any material, compound, mixture or preparation containing any quantity of the following substances, including its salts, esters and ethers. |
| Exact Mass |
270.161979946 u |
| Formula |
C18H22O2 |
| InChI |
InChI=1S/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h10,15-16H,2-9H2,1H3/t15-,16+,18+/m1/s1 |
| InChIKey |
BHTWZQKERRCPRZ-RYRKJORJSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
270.372 g/mol |
| Nominal Mass |
270 u |
| Quality |
997 |
| Retention Index |
2072 |
| SMILES |
[C@@]12([C@]3([C@@](C(CC3)=O)(CCC1=C1C(CC2)=CC(CC1)=O)C)[H])[H] |
| SPLASH |
splash10-00di-3910000000-d7c550d5eea26ff1714d |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Estradienedione
13-Methyl-1,6,7,8,11,12,13,14,15,16-decahydro-3H-cyclopenta[a]phenanthrene-3,17(2H)-dione |
| Technique |
GC/MS |
| Wiley ID |
DD2024_031695 |
