| SpectraBase Compound ID | 1znR9WzG1qi |
|---|---|
| InChI | InChI=1S/C21H34O/c1-15-10-13-20-19(18(15)9-6-7-16(2)22)12-11-17-8-4-5-14-21(17,20)3/h17-20H,1,4-14H2,2-3H3 |
| InChIKey | RIDAXYXCWSNZLR-UHFFFAOYSA-N |
| Mol Weight | 302.5 g/mol |
| Molecular Formula | C21H34O |
| Exact Mass | 302.260966 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LQeNsNP2fZ6 |
|---|---|
| Name | 13,17-Seco-5.alpha.-pregn-13(18)-en-20-one |
| CAS Registry Number | 31239-27-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H34O |
| InChI | InChI=1S/C21H34O/c1-15-10-13-20-19(18(15)9-6-7-16(2)22)12-11-17-8-4-5-14-21(17,20)3/h17-20H,1,4-14H2,2-3H3 |
| InChIKey | RIDAXYXCWSNZLR-UHFFFAOYSA-N |
| Molecular Weight | 302.502 g/mol |
| SMILES | CC12C3C(C(CCCC(C)=O)C(CC3)=C)CCC1CCCC2 |
| SPLASH | splash10-066u-8930000000-3bc1fcddd6aea5fb50ab |
| Source of Spectrum | SD-1981-0-0 |
| Synonyms | 5-(4b-Methyl-2-methylenetetradecahydro-1-phenanthrenyl)-2-pentanone 5-(4b-methyl-2-methylene-1,3,4,4a,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-1-yl)-2-pentanone 5-(4b-methyl-2-methylene-1,3,4,4a,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-1-yl)pentan-2-one 5-(4b-methyl-2-methylidene-1,3,4,4a,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-1-yl)pentan-2-one |
| Wiley ID | 1305259 |