| SpectraBase Compound ID | 8fsMhFNJ1Ks |
|---|---|
| InChI | InChI=1S/C28H49FS/c1-19(2)9-7-6-8-10-20-12-14-23-22-13-11-21-17-26(30-5)25(29)18-28(21,4)24(22)15-16-27(20,23)3/h19-26H,6-18H2,1-5H3/t20-,21-,22-,23-,24-,25-,26-,27+,28-/m0/s1 |
| InChIKey | OBNPFABIYJQFIL-XKVSFVCGSA-N |
| Mol Weight | 436.8 g/mol |
| Molecular Formula | C28H49FS |
| Exact Mass | 436.353901 g/mol |
19F Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C110hmhVuk5 |
|---|---|
| Name | 2-BETA-FLUORO-3-ALPHA-(METHYLTHIO)-5-ALPHA-CHOLESTANE |
| CAS Registry Number | 122910-83-2 |
| Compound Number | 25 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H49FS |
| InChI | InChI=1S/C28H49FS/c1-19(2)9-7-6-8-10-20-12-14-23-22-13-11-21-17-26(30-5)25(29)18-28(21,4)24(22)15-16-27(20,23)3/h19-26H,6-18H2,1-5H3/t20-,21-,22-,23-,24-,25-,26-,27+,28-/m0/s1 |
| InChIKey | OBNPFABIYJQFIL-XKVSFVCGSA-N |
| Literature Reference Author | G.HAUFE,G.ALVERNHE,D.ANKER,A.LAURENT,C.SALUZZO |
| Literature Reference Citation | J.ORG.CHEM.,57,714(1992) |
| Literature Reference DOI | 10.1021/jo00028a056 |
| Solvent | Unknown |
| Source File Reference | UWCS543 |