| SpectraBase Compound ID | 8POQ2i9NoMP |
|---|---|
| InChI | InChI=1S/C29H48O/c1-18(2)8-7-9-19(3)23-10-11-24-21-12-15-29-17-26(30)22(20(29)4)16-28(29,6)25(21)13-14-27(23,24)5/h18-25H,7-17H2,1-6H3/t19-,20?,21+,22+,23-,24+,25+,27-,28-,29+/m1/s1 |
| InChIKey | OUOFIQOQCZPNSC-DSPQAKKTSA-N |
| Mol Weight | 412.7 g/mol |
| Molecular Formula | C29H48O |
| Exact Mass | 412.370516 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IYoQj6A9H0n |
|---|---|
| Name | 2-ALPHA,5-ALPHA-(1,1-ETHYLIDEN)-3-CHOLESTANONE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H48O |
| InChI | InChI=1S/C29H48O/c1-18(2)8-7-9-19(3)23-10-11-24-21-12-15-29-17-26(30)22(20(29)4)16-28(29,6)25(21)13-14-27(23,24)5/h18-25H,7-17H2,1-6H3/t19-,20?,21+,22+,23-,24+,25+,27-,28-,29+/m1/s1 |
| InChIKey | OUOFIQOQCZPNSC-DSPQAKKTSA-N |
| Literature Reference Author | F.M.WINNIK,P.YATES |
| Literature Reference Citation | MAGN.RES.CHEM.,23,822(1985) |
| Literature Reference DOI | 10.1002/mrc.1260231007 |
| Molecular Weight | 412.700 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UNIW20449 |