![3.beta.-[(Bromomercurio)methyl]-5-vinyl-A,B-bisnor-5.beta.-cholestane](/api/spectrum/E9qvoJqPB0c/structure.png?h=300&w=458 "3.beta.-[(Bromomercurio)methyl]-5-vinyl-A,B-bisnor-5.beta.-cholestane")
| SpectraBase Compound ID | 6u2XUztNWAP |
|---|---|
| InChI | InChI=1S/C28H47.BrH.Hg/c1-8-28-17-22-16-23-12-13-24(20(4)11-9-10-19(2)3)26(23,6)18-25(22)27(28,7)15-14-21(28)5;;/h8,19-25H,1,5,9-18H2,2-4,6-7H3;1H;/q;;+1/p-1/t20-,21+,22?,23+,24-,25?,26+,27-,28-;;/m1../s1 |
| InChIKey | HWZJKQJCPMVFSI-NLTXETKISA-M |
| Mol Weight | 664.2 g/mol |
| Molecular Formula | C28H47BrHg |
| Exact Mass | 664.256759 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | E9qvoJqPB0c |
|---|---|
| Name | 3.beta.-[(Bromomercurio)methyl]-5-vinyl-A,B-bisnor-5.beta.-cholestane |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H47BrHg |
| InChI | InChI=1S/C28H47.BrH.Hg/c1-8-28-17-22-16-23-12-13-24(20(4)11-9-10-19(2)3)26(23,6)18-25(22)27(28,7)15-14-21(28)5;;/h8,19-25H,1,5,9-18H2,2-4,6-7H3;1H;/q;;+1/p-1/t20-,21+,22?,23+,24-,25?,26+,27-,28-;;/m1../s1 |
| InChIKey | HWZJKQJCPMVFSI-NLTXETKISA-M |
| Molecular Weight | 664.180 g/mol |
| SMILES | [C@]12([C@@](CC3C2C[C@@]2([C@](CC[C@@]2([H])C3)([C@@](CCCC(C)C)(C)[H])[H])C)(C=C)[C@@](C[Hg]Br)(CC1)[H])C |
| SPLASH | splash10-001i-0009000000-11f339444b8986cf0572 |
| Source of Spectrum | J-64-114-32 |
| Wiley ID | 848897 |