| SpectraBase Spectrum ID |
2cOyhZ1na11 |
| Name |
Spironolactone |
| Copyright |
Copyright © 2012-2024 John Wiley & Sons, Inc. Portions provided by AAFS, Toxicology Section. All Rights Reserved. |
| Formula |
C24H32O4S |
| InChI |
InChI=1S/C24H32O4S/c1-14(25)29-19-13-15-12-16(26)4-8-22(15,2)17-5-9-23(3)18(21(17)19)6-10-24(23)11-7-20(27)28-24/h12,17-19,21H,4-11,13H2,1-3H3/t17-,18-,19+,21+,22-,23-,24+/m0/s1 |
| InChIKey |
LXMSZDCAJNLERA-ZHYRCANASA-N |
| SMILES |
[C@@]12(CCC(C=C1C[C@]([C@]1([C@]3([C@](CC[C@]21[H])([C@@]1(CC3)CCC(O1)=O)C)[H])[H])(SC(C)=O)[H])=O)C |
| SPLASH |
splash10-0006-9836000000-48dbcbe33863a92eb124 |
| Source of Spectrum |
Mass Spectrometry Committee of the Toxicology Section of the American Academy of Forensic Sciences |
