| SpectraBase Compound ID | 9xzzMPQMjwU |
|---|---|
| InChI | InChI=1S/C25H42O4/c1-15(5-10-23(28)29-4)19-8-9-20-18-7-6-16-13-17(26)11-12-24(16,2)21(18)14-22(27)25(19,20)3/h15-22,26-27H,5-14H2,1-4H3/t15-,16-,17-,18+,19-,20+,21+,22+,24+,25-/m1/s1 |
| InChIKey | ZHUOOEGSSFNTNP-JMKDMENQSA-N |
| Mol Weight | 406.6 g/mol |
| Molecular Formula | C25H42O4 |
| Exact Mass | 406.30831 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 69PC2LSMaM0 |
|---|---|
| Name | METHYL-DESOXYCHOLATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H42O4 |
| InChI | InChI=1S/C25H42O4/c1-15(5-10-23(28)29-4)19-8-9-20-18-7-6-16-13-17(26)11-12-24(16,2)21(18)14-22(27)25(19,20)3/h15-22,26-27H,5-14H2,1-4H3/t15-,16-,17-,18+,19-,20+,21+,22+,24+,25-/m1/s1 |
| InChIKey | ZHUOOEGSSFNTNP-JMKDMENQSA-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 | 406.606 g/mol |
| Solvent | CH2Cl2 |
| Source File Reference | UNIW11450 |