| SpectraBase Spectrum ID |
8IePs8ESyCe |
| Name |
Estr-5(10)-ene-3,17-dione |
| Classification |
Steroid |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
272.177630011 u |
| Formula |
C18H24O2 |
| InChI |
InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h14-16H,2-10H2,1H3/t14-,15-,16+,18+/m1/s1 |
| InChIKey |
RORYLAUXKSWMQL-CBZIJGRNSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
272.388 g/mol |
| Nominal Mass |
272 u |
| Quality |
992 |
| Retention Index |
2084 |
| SMILES |
[C@@]12([C@]3([C@@](C(CC3)=O)(CC[C@@]1(C1=C(CC2)CC(CC1)=O)[H])C)[H])[H] |
| SPLASH |
splash10-05vo-7930000000-d13b6b69ff778bb0e339 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
19-Nor-5(10)androstene-3,17-dione
(3aS,3bR,9bS,11aS)-11a-methyl-2,3,3a,4,5,6,8,9,9b,10,11,11a-dodecahydro-1H-cyclopenta[a]\rphenanthrene-1,7(3bH)-dione |
| Technique |
GC/MS |
| Wiley ID |
DD2024_019641 |
