| SpectraBase Compound ID | E5PwoYzla93 |
|---|---|
| InChI | InChI=1S/C35H54O4S/c1-24(2)8-7-9-26(4)31-16-17-32-30-15-12-27-22-28(38-6)18-21-35(27,33(30)19-20-34(31,32)5)23-39-40(36,37)29-13-10-25(3)11-14-29/h10-14,24,26,28,30-33H,7-9,15-23H2,1-6H3/t26-,28+,30+,31-,32+,33+,34-,35-/m1/s1 |
| InChIKey | CYXFJYAWNSXIMB-GVRISNGGSA-N |
| Mol Weight | 570.9 g/mol |
| Molecular Formula | C35H54O4S |
| Exact Mass | 570.374281 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4B0RAjZhQnq |
|---|---|
| Name | 3-BETA-METHOXY-CHOLEST-5-ENE-19-OL-19-PARA-TOLUENESULFONATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H54O4S |
| InChI | InChI=1S/C35H54O4S/c1-24(2)8-7-9-26(4)31-16-17-32-30-15-12-27-22-28(38-6)18-21-35(27,33(30)19-20-34(31,32)5)23-39-40(36,37)29-13-10-25(3)11-14-29/h10-14,24,26,28,30-33H,7-9,15-23H2,1-6H3/t26-,28+,30+,31-,32+,33+,34-,35-/m1/s1 |
| InChIKey | CYXFJYAWNSXIMB-GVRISNGGSA-N |
| Literature Reference Author | K.N.SCOTT,T.H.MARECI |
| Literature Reference Citation | CAN.J.CHEM.,57,27(1979) |
| Literature Reference DOI | 10.1139/v79-005 |
| Molecular Weight | 570.871 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED972 |