| SpectraBase Compound ID | 4GJxGGxM7V7 |
|---|---|
| InChI | InChI=1S/3C13H17FO3S/c2*1-2-3-5-10-12-13(14,17-12)18(15,16)11-8-6-4-7-9-11;1-2-3-5-10-12(14)13(15)18(16,17)11-8-6-4-7-9-11/h3*4,6-9,12H,2-3,5,10H2,1H3/t2*12?,13-;/m10./s1 |
| InChIKey | BCROUEUQWUAFSV-LFSKUXMUSA-N |
| Mol Weight | 817.0 g/mol |
| Molecular Formula | C39H51F3O9S3 |
| Exact Mass | 816.264731 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3ST8Swt7OJn |
|---|---|
| Name | 1-FLUORO-1-(PHENYLSULFONYL)-1,2-EPOXY-HEPTANE;4-OXO-4-(PHENYLSULFONYL)-3-FLUORO-HEPTANE |
| Compound Number | 13D/18D |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H51F3O9S3 |
| InChI | InChI=1S/3C13H17FO3S/c2*1-2-3-5-10-12-13(14,17-12)18(15,16)11-8-6-4-7-9-11;1-2-3-5-10-12(14)13(15)18(16,17)11-8-6-4-7-9-11/h3*4,6-9,12H,2-3,5,10H2,1H3/t2*12?,13-;/m10./s1 |
| InChIKey | BCROUEUQWUAFSV-LFSKUXMUSA-N |
| Literature Reference Author | A.K.SAIKIA,S.TSUBOI |
| Literature Reference Citation | J.ORG.CHEM.,66,643(2001) |
| Literature Reference DOI | 10.1021/jo000825r |
| Molecular Weight | 817.004 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS27577 |