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(2S,3S)-Benzoic acid 1-Benzyloxymethyl-3,3,3-trifluoro-2-hydroxypropyl ester
SpectraBase Compound ID 30XIGDG5OY6
InChI InChI=1S/C18H17F3O4/c19-18(20,21)16(22)15(12-24-11-13-7-3-1-4-8-13)25-17(23)14-9-5-2-6-10-14/h1-10,15-16,22H,11-12H2/t15-,16-/m0/s1
InChIKey QJDDXXVNIZAKCI-HOTGVXAUSA-N
Mol Weight 354.33 g/mol
Molecular Formula C18H17F3O4
Exact Mass 354.107894 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8HwfWsmmybZ
Name (2S,3S)-BENZOIC-ACID-1-BENZYLOXYMETHYL-3,3,3-TRIFLUORO-2-HYDROXYPROPYLESTER
Compound Number 4D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H17F3O4
InChI InChI=1S/C18H17F3O4/c19-18(20,21)16(22)15(12-24-11-13-7-3-1-4-8-13)25-17(23)14-9-5-2-6-10-14/h1-10,15-16,22H,11-12H2/t15-,16-/m0/s1
InChIKey QJDDXXVNIZAKCI-HOTGVXAUSA-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 UWVN22225