![2'-.psi.-Methoxy-spiro[5-.alpha.-cholestane-3,1'-cyclobutan]-3'-one](/api/spectrum/8Hrp3n1l1Lq/structure.png?h=300&w=458 "2'-.psi.-Methoxy-spiro[5-.alpha.-cholestane-3,1'-cyclobutan]-3'-one")
| SpectraBase Compound ID | G1xZmWit5oe |
|---|---|
| InChI | InChI=1S/C31H52O2/c1-20(2)8-7-9-21(3)24-12-13-25-23-11-10-22-18-31(19-27(32)28(31)33-6)17-16-29(22,4)26(23)14-15-30(24,25)5/h20-26,28H,7-19H2,1-6H3/t21-,22+,23+,24-,25+,26+,28?,29+,30-,31?/m1/s1 |
| InChIKey | BDSLWVNVMSMEIV-SZGLDSHSSA-N |
| Mol Weight | 456.8 g/mol |
| Molecular Formula | C31H52O2 |
| Exact Mass | 456.396731 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8Hrp3n1l1Lq |
|---|---|
| Name | 2'-.psi.-Methoxy-spiro[5-.alpha.-cholestane-3,1'-cyclobutan]-3'-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C31H52O2 |
| InChI | InChI=1S/C31H52O2/c1-20(2)8-7-9-21(3)24-12-13-25-23-11-10-22-18-31(19-27(32)28(31)33-6)17-16-29(22,4)26(23)14-15-30(24,25)5/h20-26,28H,7-19H2,1-6H3/t21-,22+,23+,24-,25+,26+,28?,29+,30-,31?/m1/s1 |
| InChIKey | BDSLWVNVMSMEIV-SZGLDSHSSA-N |
| Molecular Weight | 456.755 g/mol |
| SMILES | [C@@]12([C@]([C@]3([C@]([C@@]4([C@@](CC5(CC4)C(C(=O)C5)OC)([H])CC3)C)([H])CC2)[H])(CC[C@@]1([C@@](CCCC(C)C)(C)[H])[H])[H])C |
| SPLASH | splash10-03e9-2030900000-ca7b309905b48486c1f2 |
| Source of Spectrum | U-1995-344-11 |
| Wiley ID | 766462 |