| SpectraBase Compound ID | IH0fs4nV36t |
|---|---|
| InChI | InChI=1S/2C21H29F3O8S/c2*1-14(15(2)32-33(5,27)28)13-18(31-16(3)25)11-12-30-19(26)20(29-4,21(22,23)24)17-9-7-6-8-10-17/h2*6-10,14-15,18H,11-13H2,1-5H3/t14-,15+,18+,20-;14-,15-,18-,20+/m00/s1 |
| InChIKey | POYRKYGWFPRWSC-PIZVFWAQSA-N |
| Mol Weight | 997.02 g/mol |
| Molecular Formula | C42H58F6O16S2 |
| Exact Mass | 996.307047 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IPLF7HkCvhe |
|---|---|
| Name | POYRKYGWFPRWSC-PIZVFWAQSA-N |
| Compound Number | 15A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H58F6O16S2 |
| InChI | InChI=1S/2C21H29F3O8S/c2*1-14(15(2)32-33(5,27)28)13-18(31-16(3)25)11-12-30-19(26)20(29-4,21(22,23)24)17-9-7-6-8-10-17/h2*6-10,14-15,18H,11-13H2,1-5H3/t14-,15+,18+,20-;14-,15-,18-,20+/m00/s1 |
| InChIKey | POYRKYGWFPRWSC-PIZVFWAQSA-N |
| Literature Reference Author | J.KOBAYASHI,T.KUBOTA,T.ENDO,M.TSUDA |
| Literature Reference Citation | J.ORG.CHEM.,66,134(2001) |
| Literature Reference DOI | 10.1021/jo005607c |
| Molecular Weight | 997.023 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS28099 |