SpectraBase Compound ID | 82E6qyB4DIn |
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InChI | InChI=1S/C25H42O2/c1-17(8-13-23(26)27-4)20-11-12-21-19-10-9-18-7-5-6-15-24(18,2)22(19)14-16-25(20,21)3/h17-22H,5-16H2,1-4H3/t17-,18+,19+,20-,21+,22+,24+,25-/m1/s1 |
InChIKey | YHTRVWPOAJKWBV-ZXKBGTPZSA-N |
Mol Weight | 374.6 g/mol |
Molecular Formula | C25H42O2 |
Exact Mass | 374.318481 g/mol |
SpectraBase Spectrum ID | 9wYIzrrxEhj |
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Name | METHYL-CHOLANATE |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C25H42O2 |
InChI | InChI=1S/C25H42O2/c1-17(8-13-23(26)27-4)20-11-12-21-19-10-9-18-7-5-6-15-24(18,2)22(19)14-16-25(20,21)3/h17-22H,5-16H2,1-4H3/t17-,18+,19+,20-,21+,22+,24+,25-/m1/s1 |
InChIKey | YHTRVWPOAJKWBV-ZXKBGTPZSA-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 | 374.607 g/mol |
Solvent | CH2Cl2 |
Source File Reference | UNIW11447 |