| SpectraBase Spectrum ID |
LDzH0OYKqwF |
| Name |
Pregn-4-en-3-one |
| Alternate Name(s) |
17-ethyl-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H32O |
| InChI |
InChI=1S/C21H32O/c1-4-14-6-8-18-17-7-5-15-13-16(22)9-11-21(15,3)19(17)10-12-20(14,18)2/h13-14,17-19H,4-12H2,1-3H3/t14?,17?,18?,19?,20-,21+/m1/s1 |
| InChIKey |
AYGFEWYXKDFVIQ-ZCGKSTCESA-N |
| Molecular Weight |
300.486 g/mol |
| SMILES |
[C@@]12(C(=CC(CC2)=O)CCC2C3CCC([C@]3(CCC12)C)CC)C |
| SPLASH |
splash10-0uk9-0945000000-9c5b7a5e77127dee215e |
| Source of Spectrum |
PS-50-1739-20 |
| Wiley ID |
1303494 |
