| SpectraBase Compound ID | 3wEGXad9Y34 |
|---|---|
| InChI | InChI=1S/C26H40O6/c1-16(4-9-24(29)30)20-7-8-21-19-6-5-17-12-18(31-14-27)10-11-25(17,2)22(19)13-23(32-15-28)26(20,21)3/h14-23H,4-13H2,1-3H3,(H,29,30)/t16-,17-,18-,19+,20-,21+,22+,23+,25+,26-/m1/s1 |
| InChIKey | JFAHDZYELPHHBK-VAYUFCLWSA-N |
| Mol Weight | 448.6 g/mol |
| Molecular Formula | C26H40O6 |
| Exact Mass | 448.282489 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KBIu0MTUN0W |
|---|---|
| Name | 3,12-Dihydroxycholan-24-oic acid, diformate |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C26H40O6 |
| InChI | InChI=1S/C26H40O6/c1-16(4-9-24(29)30)20-7-8-21-19-6-5-17-12-18(31-14-27)10-11-25(17,2)22(19)13-23(32-15-28)26(20,21)3/h14-23H,4-13H2,1-3H3,(H,29,30)/t16-,17-,18-,19+,20-,21+,22+,23+,25+,26-/m1/s1 |
| InChIKey | JFAHDZYELPHHBK-VAYUFCLWSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 42323M |
| Solvent | CDCl3 |