| SpectraBase Compound ID | 7hiqvdlknEF |
|---|---|
| InChI | InChI=1S/C20H26O2/c1-11-12(2)19-13(10-17(11)21)4-5-14-15(19)8-9-20(3)16(14)6-7-18(20)22/h10,14-16,21H,4-9H2,1-3H3 |
| InChIKey | JRPZUYCNRRIOPA-UHFFFAOYSA-N |
| Mol Weight | 298.43 g/mol |
| Molecular Formula | C20H26O2 |
| Exact Mass | 298.19328 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LMQJSGo7GM4 |
|---|---|
| Name | Estra-1,3,5(10)-trien-17-one, 3-hydroxy-1,2-dimethyl- |
| CAS Registry Number | 1094-07-1 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H26O2 |
| InChI | InChI=1S/C20H26O2/c1-11-12(2)19-13(10-17(11)21)4-5-14-15(19)8-9-20(3)16(14)6-7-18(20)22/h10,14-16,21H,4-9H2,1-3H3 |
| InChIKey | JRPZUYCNRRIOPA-UHFFFAOYSA-N |
| Molecular Weight | 298.426 g/mol |
| SMILES | Oc1cc2CCC3C(CCC4(C)C3CCC4=O)c2c(C)c1C |
| SPLASH | splash10-01vk-1980000000-20d9395fbd5a5af8e021 |
| Source of Spectrum | DE-0-42-0 |
| Synonyms | 3-Hydroxy-1,2-dimethylestra-1(10),2,4-trien-17-one 1,2,13-trimethyl-3-oxidanyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one 3-Hydroxy-1,2,13-trimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one |
| Wiley ID | 44267 |