| SpectraBase Compound ID | AG2m9qSiFO4 |
|---|---|
| InChI | InChI=1S/C34H52O2/c1-23(2)10-9-11-24(3)29-16-17-30-28-15-14-26-22-27(36-32(35)25-12-7-6-8-13-25)18-20-33(26,4)31(28)19-21-34(29,30)5/h6-8,12-13,23-24,26-31H,9-11,14-22H2,1-5H3/t24-,26+,27+,28+,29-,30+,31+,33+,34?/m1/s1 |
| InChIKey | YVXZAWFNDQLXBU-WMNKMEBVSA-N |
| Mol Weight | 492.8 g/mol |
| Molecular Formula | C34H52O2 |
| Exact Mass | 492.396731 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JCluSg5Ochi |
|---|---|
| Name | 3-BETA-BENZOYLOXY-CHOLESTANE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H52O2 |
| InChI | InChI=1S/C34H52O2/c1-23(2)10-9-11-24(3)29-16-17-30-28-15-14-26-22-27(36-32(35)25-12-7-6-8-13-25)18-20-33(26,4)31(28)19-21-34(29,30)5/h6-8,12-13,23-24,26-31H,9-11,14-22H2,1-5H3/t24-,26+,27+,28+,29-,30+,31+,33+,34?/m1/s1 |
| InChIKey | YVXZAWFNDQLXBU-WMNKMEBVSA-N |
| Literature Reference Author | S.S.RAMOS,L.SANTOS,P.ALMEIDA,W.B.MONTHERWELL,M.C.COSTA |
| Literature Reference Citation | MAGN.RES.CHEM.,43,861(2005) |
| Literature Reference DOI | 10.1002/mrc.1635 |
| Molecular Weight | 492.786 g/mol |
| Sample ID | 27608 |
| Solvent | CDCl3 |