| SpectraBase Compound ID | FKatFWyX3Gq |
|---|---|
| InChI | InChI=1S/C17H29BrO3/c1-10(2)12-6-8-16(4)13(18)7-9-17(5,20)15(16)14(12)21-11(3)19/h10,12-15,20H,6-9H2,1-5H3/t12-,13-,14+,15-,16+,17-/m1/s1 |
| InChIKey | STGVJNXXFGCHPJ-RGGMIXCSSA-N |
| Mol Weight | 361.32 g/mol |
| Molecular Formula | C17H29BrO3 |
| Exact Mass | 360.130008 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 73KrJ2kztqL |
|---|---|
| Name | AUSTRADIOL-ACETATE |
| CAS Registry Number | 82731-83-7 |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C17H29BrO3 |
| InChI | InChI=1S/C17H29BrO3/c1-10(2)12-6-8-16(4)13(18)7-9-17(5,20)15(16)14(12)21-11(3)19/h10,12-15,20H,6-9H2,1-5H3/t12-,13-,14+,15-,16+,17-/m1/s1 |
| InChIKey | STGVJNXXFGCHPJ-RGGMIXCSSA-N |
| Literature Reference Author | M.R.BRENNAN,K.L.ERICKSON |
| Literature Reference Citation | J.ORG.CHEM.,47,3917(1982) |
| Literature Reference DOI | 10.1021/jo00141a021 |
| Molecular Weight | 361.319 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS11254 |