![3-METHYL-3-TRIFLUOROMETHYL-2-THIABICYCLO-[2.2.1]-HEPT-5-EN-OXIDE](/api/spectrum/IqspBRuh8R0/structure.png?h=300&w=458 "3-METHYL-3-TRIFLUOROMETHYL-2-THIABICYCLO-[2.2.1]-HEPT-5-EN-OXIDE")
| SpectraBase Compound ID | 7xAHITgsVTo |
|---|---|
| InChI | InChI=1S/C8H9F3OS/c1-7(8(9,10)11)5-2-3-6(4-5)13(7)12/h2-3,5-6H,4H2,1H3/t5-,6+,7+,13?/m0/s1 |
| InChIKey | JGJFLWJAEWFDRY-IYTVPXFQSA-N |
| Mol Weight | 210.21 g/mol |
| Molecular Formula | C8H9F3OS |
| Exact Mass | 210.032621 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IqspBRuh8R0 |
|---|---|
| Name | 3-METHYL-3-TRIFLUOROMETHYL-2-THIABICYCLO-[2.2.1]-HEPT-5-EN-OXIDE |
| CAS Registry Number | 122491-47-8 |
| Compound Number | 16B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C8H9F3OS |
| InChI | InChI=1S/C8H9F3OS/c1-7(8(9,10)11)5-2-3-6(4-5)13(7)12/h2-3,5-6H,4H2,1H3/t5-,6+,7+,13?/m0/s1 |
| InChIKey | JGJFLWJAEWFDRY-IYTVPXFQSA-N |
| Literature Reference Author | B.SCHULER,W.SUNDERMEYER |
| Literature Reference Citation | CHEM.BER.,123,177(1990) |
| Literature Reference DOI | 10.1002/cber.19901230130 |
| Molecular Weight | 210.214 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED12271 |