| SpectraBase Spectrum ID |
4I0baBDg6x |
| Name |
PREGNA-4,16-DIENE-3,20-DIONE |
| CAS Registry Number |
1096-38-4 |
| Copyright |
Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C21H28O2 |
| InChI |
InChI=1S/C21H28O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h6,12,16,18-19H,4-5,7-11H2,1-3H3 |
| InChIKey |
VRRHHTISESGZFN-UHFFFAOYSA-N |
| Nominal Mass |
312 u |
| Owner |
Database Compilation (C) 2005 Wiley & Sons, Inc. |
| SMILES |
CC12CCC(=O)C=C2CCC2C3CC=C(C3(CCC12)C)C(=O)C |
| SPLASH |
splash10-01ox-9643000000-6450a84633d66c12afc0 |
| Source File Reference |
LMCM-97506-352P |
| Source of Spectrum |
Copyright (C) Prof. Spiteller, University Bayreuth, Germany |
