| SpectraBase Compound ID | AWxEBEUHEcH |
|---|---|
| InChI | InChI=1S/C27H35ClO2Se/c1-25-13-10-19(29)16-18(25)8-9-21-22(25)11-14-26(2)23(21)12-15-27(26,30)24(17-28)31-20-6-4-3-5-7-20/h3-8,17,19,21-23,29-30H,9-16H2,1-2H3/b24-17-/t19-,21+,22-,23-,25-,26-,27+/m0/s1 |
| InChIKey | LADMBKUHBDMIKM-RXXJEVKWSA-N |
| Mol Weight | 506.0 g/mol |
| Molecular Formula | C27H35ClO2Se |
| Exact Mass | 506.14908 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BSwYFhD82g7 |
|---|---|
| Name | 5-ANDROSTEN-17-ALPHA-(E-1'-PHENYLSELENO-2'-CHLOROETHENYL)-3-BETA,17-BETA-DIOL |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H35ClO2Se |
| InChI | InChI=1S/C27H35ClO2Se/c1-25-13-10-19(29)16-18(25)8-9-21-22(25)11-14-26(2)23(21)12-15-27(26,30)24(17-28)31-20-6-4-3-5-7-20/h3-8,17,19,21-23,29-30H,9-16H2,1-2H3/b24-17-/t19-,21+,22-,23-,25-,26-,27+/m0/s1 |
| InChIKey | LADMBKUHBDMIKM-RXXJEVKWSA-N |
| Literature Reference Author | D.G.GARRATT,P.L.BEAULIEU,V.M.MORISSET |
| Literature Reference Citation | CAN.J.CHEM.,59,927(1981) |
| Literature Reference DOI | 10.1139/v81-134 |
| Molecular Weight | 505.987 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED5691 |