| SpectraBase Spectrum ID |
64WvVjKiXSC |
| Name |
Estra-2,5,7,9-tetraene-1,4,17-trione, 14-methyl- |
| CAS Registry Number |
107648-14-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H18O3 |
| InChI |
InChI=1S/C19H18O3/c1-18-10-8-16(22)19(18,2)9-7-11-13(18)4-3-12-14(20)5-6-15(21)17(11)12/h3-6H,7-10H2,1-2H3/t18-,19+/m0/s1 |
| InChIKey |
VDOCSPMPQOGOGH-RBUKOAKNSA-N |
| Molecular Weight |
294.350 g/mol |
| SMILES |
[C@]12([C@@](C(=O)CC2)(CCc2c1ccc1C(C=CC(c21)=O)=O)C)C |
| SPLASH |
splash10-0f6x-0090000000-17626c9f1d9959a3875c |
| Source of Spectrum |
F-42-3450-14 |
| Synonyms |
14-Methyl-estra-2,5(10),6-triene-1,4,7-trione
14-Methylestra-2,5,7,9-tetraene-1,4,17-trione |
| Wiley ID |
1297549 |
