| SpectraBase Compound ID | BNtTkfFIIN1 |
|---|---|
| InChI | InChI=1S/2C17H18F11N3OS.2FH/c2*1-10(2)7-4-5-11(10,3)8(6-7)30-31-9-29-15(32,17(26,27)28)14(22,33-9)12(18,19)13(20,21)16(23,24)25;;/h2*7,32H,4-6H2,1-3H3,(H,29,31);2*1H/b2*30-8+;;/t7-,11+,14+,15+;7-,11+,14-,15-;;/m10../s1 |
| InChIKey | LXYLTCOEDULQCS-KDEWLDOASA-N |
| Mol Weight | 1082.799675926 g/mol |
| Molecular Formula | C34H38F24N6O2S2 |
| Exact Mass | 1082.211443 g/mol |
19F Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GEVS1k3KgYS |
|---|---|
| Name | (S)-CAMPHOR-(4RS,5RS)-5-FLUORO-4-HYDROXY-5-HEPTAFLUOROPROPYL-4-TRIFLUOROMETHYL-4,5-DIHYDROTHIAZOL-2-YLHYDRAZONE_HYDRATE |
| Compound Number | VIII-(1S,4'RS,5'RS) |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H38F24N6O2S2 |
| InChI | InChI=1S/2C17H18F11N3OS.2FH/c2*1-10(2)7-4-5-11(10,3)8(6-7)30-31-9-29-15(32,17(26,27)28)14(22,33-9)12(18,19)13(20,21)16(23,24)25;;/h2*7,32H,4-6H2,1-3H3,(H,29,31);2*1H/b2*30-8+;;/t7-,11+,14+,15+;7-,11+,14-,15-;;/m10../s1 |
| InChIKey | LXYLTCOEDULQCS-KDEWLDOASA-N |
| Literature Reference Author | L.V.SALOUTINA,A.Y.ZAPEVALOV,M.I.KODESS,V.I.SALOUTIN,O.N.CHUP AKHIN |
| Literature Reference Citation | RUSS.J.ORG.CHEM.,37,1522(2001) |
| Literature Reference DOI | 10.1023/A:1013887515644 |
| Solvent | DMSO-D6 |
| Source File Reference | UWMZ10431 |