| SpectraBase Compound ID | GrOHI8ScHyT |
|---|---|
| InChI | InChI=1S/C29H44O7/c1-16(7-10-26(33)34-6)21-8-9-22-27-23(15-25(32)29(21,22)5)28(4)12-11-20(35-17(2)30)13-19(28)14-24(27)36-18(3)31/h16,19-24,27H,7-15H2,1-6H3/t16-,19+,20-,21-,22+,23+,24-,27+,28+,29-/m1/s1 |
| InChIKey | GVIZCQOBODPSLY-ZNYVGMLLSA-N |
| Mol Weight | 504.7 g/mol |
| Molecular Formula | C29H44O7 |
| Exact Mass | 504.308704 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | EpZKUjJTBWT |
|---|---|
| Name | 3α,7α-dihydroxy-12-oxo-5β-cholan-24-oic acid, methyl ester, diacetate |
| CAS Registry Number | 28535-81-1 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Detector Name | TGS/TRIGLYCINE SULFATE/ |
| Formula | C29H44O7 |
| InChI | InChI=1S/C29H44O7/c1-16(7-10-26(33)34-6)21-8-9-22-27-23(15-25(32)29(21,22)5)28(4)12-11-20(35-17(2)30)13-19(28)14-24(27)36-18(3)31/h16,19-24,27H,7-15H2,1-6H3/t16-,19+,20-,21-,22+,23+,24-,27+,28+,29-/m1/s1 |
| InChIKey | GVIZCQOBODPSLY-ZNYVGMLLSA-N |
| Instrument Name | DIGILAB FTS-14 |
| Molecular Weight | 504.67 |
| Technique | Vapor Phase |