| SpectraBase Compound ID | LhaPb5FWsjA |
|---|---|
| InChI | InChI=1S/C28H43F3O3S/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(34-35(32,33)28(29,30)31)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,17-19,22-25H,6-8,10-16H2,1-5H3/t19-,22?,23-,24?,25?,26+,27-/m1/s1 |
| InChIKey | UYJNHTHJEJEAQJ-SSNGJPOWSA-N |
| Mol Weight | 516.7 g/mol |
| Molecular Formula | C28H43F3O3S |
| Exact Mass | 516.288501 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8I5AmLJndP4 |
|---|---|
| Name | Cholesta-3,5-dien-3-yl trifluoromethanesulphonate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H43F3O3S |
| InChI | InChI=1S/C28H43F3O3S/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(34-35(32,33)28(29,30)31)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,17-19,22-25H,6-8,10-16H2,1-5H3/t19-,22?,23-,24?,25?,26+,27-/m1/s1 |
| InChIKey | UYJNHTHJEJEAQJ-SSNGJPOWSA-N |
| Molecular Weight | 516.704 g/mol |
| SMILES | C(S(OC1=CC2=CCC3C4CC[C@@]([C@]4(CCC3[C@]2(CC1)C)C)([C@@](CCCC(C)C)(C)[H])[H])(=O)=O)(F)(F)F |
| SPLASH | splash10-0006-9013020000-46f43002841a5de69696 |
| Source of Spectrum | F-48-3549-0 |
| Synonyms | Cholesta-3,5-dien-3-yl trifluoromethanesulfonate |
| Wiley ID | 1401420 |