| SpectraBase Compound ID | Ko4XituQo9u |
|---|---|
| InChI | InChI=1S/C25H42O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h16-22,26H,5-15H2,1-4H3/t16-,17-,18-,19+,20-,21+,22+,24+,25-/m1/s1 |
| InChIKey | YXZVCZUDUJEPPK-ULCLHEGSSA-N |
| Mol Weight | 390.6 g/mol |
| Molecular Formula | C25H42O3 |
| Exact Mass | 390.313395 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KBVsHLYzEYo |
|---|---|
| Name | METHYL-LITHOCHOLATE |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H42O3 |
| InChI | InChI=1S/C25H42O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h16-22,26H,5-15H2,1-4H3/t16-,17-,18-,19+,20-,21+,22+,24+,25-/m1/s1 |
| InChIKey | YXZVCZUDUJEPPK-ULCLHEGSSA-N |
| Literature Reference Author | D.LEIBFRITZ,J.D.ROBERTS |
| Literature Reference Citation | J.AM.CHEM.SOC.,95,4996(1973) |
| Literature Reference DOI | 10.1021/ja00796a036 |
| Molecular Weight | 390.607 g/mol |
| Solvent | CH2Cl2 |
| Source File Reference | UNIW11448 |