| SpectraBase Compound ID | 6vNQY82x0as |
|---|---|
| InChI | InChI=1S/C28H43ClO/c1-18(2)7-6-8-19(3)22-11-12-23-21-10-9-20-17-25(29)26(30)14-16-27(20,4)24(21)13-15-28(22,23)5/h9,17-19,21-24H,6-8,10-16H2,1-5H3/t19-,21+,22-,23+,24+,27+,28-/m1/s1 |
| InChIKey | XRWVXHOAIIIKIS-SKFRBLFKSA-N |
| Mol Weight | 431.1 g/mol |
| Molecular Formula | C28H43ClO |
| Exact Mass | 430.300244 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LQmpDeI1nrC |
|---|---|
| Name | A-HOMO-4-CHLORO-5-ALPHA-CHOLESTA-4,5-DIEN-3-ONE |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H43ClO |
| InChI | InChI=1S/C28H43ClO/c1-18(2)7-6-8-19(3)22-11-12-23-21-10-9-20-17-25(29)26(30)14-16-27(20,4)24(21)13-15-28(22,23)5/h9,17-19,21-24H,6-8,10-16H2,1-5H3/t19-,21+,22-,23+,24+,27+,28-/m1/s1 |
| InChIKey | XRWVXHOAIIIKIS-SKFRBLFKSA-N |
| Literature Reference Author | V.DAVE,J.B.STOTHERS |
| Literature Reference Citation | CAN.J.CHEM.,57,1550(1979) |
| Literature Reference DOI | 10.1139/v79-253 |
| Molecular Weight | 431.102 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED1601 |