| SpectraBase Compound ID | 6nzSD9zThBV |
|---|---|
| InChI | InChI=1S/C18H25NO/c1-18-9-8-14-13-5-3-12(20)10-11(13)2-4-15(14)16(18)6-7-17(18)19/h3,5,10,14-17,20H,2,4,6-9,19H2,1H3/t14?,15?,16?,17-,18-/m0/s1 |
| InChIKey | VPONVJPFULJPAN-PAOLREHBSA-N |
| Mol Weight | 271.4 g/mol |
| Molecular Formula | C18H25NO |
| Exact Mass | 271.193614 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KYOJfP9zqfi |
|---|---|
| Name | 17-Aminoestra-1,3,5(10)-trien-3-ol |
| CAS Registry Number | 20989-33-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H25NO |
| InChI | InChI=1S/C18H25NO/c1-18-9-8-14-13-5-3-12(20)10-11(13)2-4-15(14)16(18)6-7-17(18)19/h3,5,10,14-17,20H,2,4,6-9,19H2,1H3/t14?,15?,16?,17-,18-/m0/s1 |
| InChIKey | VPONVJPFULJPAN-PAOLREHBSA-N |
| Molecular Weight | 271.404 g/mol |
| SMILES | Oc1ccc2c(CCC3C4[C@@]([C@](CC4)(N)[H])(CCC23)C)c1 |
| SPLASH | splash10-0a4i-9270000000-ba6f97d423792777b43b |
| Source of Spectrum | O-27-636-0 |
| Wiley ID | 1275512 |