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(2R,3R)-Benzoic acid 1-Benzyloxymethyl-3,3,3-trifluoro-2-trifluoromethanesulfinyloxypropyl ester
SpectraBase Compound ID F7vU3n7JP5A
InChI InChI=1S/C19H16F6O6S/c20-18(21,22)16(31-32(27,28)19(23,24)25)15(12-29-11-13-7-3-1-4-8-13)30-17(26)14-9-5-2-6-10-14/h1-10,15-16H,11-12H2/t15-,16-/m1/s1
InChIKey FORZMSNVEXYZGB-HZPDHXFCSA-N
Mol Weight 486.38 g/mol
Molecular Formula C19H16F6O6S
Exact Mass 486.057178 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2RIvMVFPPc7
Name (2R,3R)-BENZOIC-ACID-1-BENZYLOXYMETHYL-3,3,3-TRIFLUORO-2-TRIFLUOROMETHANESULFINYLOXY-PROPYLESTER
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H16F6O6S
InChI InChI=1S/C19H16F6O6S/c20-18(21,22)16(31-32(27,28)19(23,24)25)15(12-29-11-13-7-3-1-4-8-13)30-17(26)14-9-5-2-6-10-14/h1-10,15-16H,11-12H2/t15-,16-/m1/s1
InChIKey FORZMSNVEXYZGB-HZPDHXFCSA-N
Literature Reference Author Z.X.JIANG,F.L.QING
Literature Reference Citation J.ORG.CHEM.,69,5486(2004)
Literature Reference DOI 10.1021/jo0497611
Solvent CDCl3
Source File Reference UWVN22230