| SpectraBase Compound ID | 8sAGveIbJSd |
|---|---|
| InChI | InChI=1S/C22H30O2/c1-13(2)19-12-20(23)22(3)10-9-17-16-8-6-15(24-4)11-14(16)5-7-18(17)21(19)22/h6,8,11,13,17-19,21H,5,7,9-10,12H2,1-4H3/t17-,18-,19+,21-,22-/m1/s1 |
| InChIKey | JZDANCKXFVFLFC-PXIKZMAHSA-N |
| Mol Weight | 326.48 g/mol |
| Molecular Formula | C22H30O2 |
| Exact Mass | 326.22458 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JVJBXQqjrYM |
|---|---|
| Name | 15-BETA-ISOPROPYL-3-METHOXY-ESTRA-1,3,5(10)-TRIEN-17-ONE |
| Compound Number | 2C |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H30O2 |
| InChI | InChI=1S/C22H30O2/c1-13(2)19-12-20(23)22(3)10-9-17-16-8-6-15(24-4)11-14(16)5-7-18(17)21(19)22/h6,8,11,13,17-19,21H,5,7,9-10,12H2,1-4H3/t17-,18-,19+,21-,22-/m1/s1 |
| InChIKey | JZDANCKXFVFLFC-PXIKZMAHSA-N |
| Literature Reference Author | J.R.BULL,M.C.LOEDOLFF |
| Literature Reference Citation | J.CHEM.SOC.PERKIN-1,1269(1996) |
| Literature Reference DOI | 10.1039/p19960001269 |
| Molecular Weight | 326.479 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS20679 |