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3-Deoxy-3-fluoro-4-o-benzyl-5-o-benzoyl-D-xylitol

View entire compound with spectra: 2 NMR

3-Deoxy-3-fluoro-4-o-benzyl-5-o-benzoyl-D-xylitol
SpectraBase Compound ID Lo6nOkjtvNb
InChI InChI=1S/C19H21FO4/c1-14(21)18(20)17(23-12-15-8-4-2-5-9-15)13-24-19(22)16-10-6-3-7-11-16/h2-11,14,17-18,21H,12-13H2,1H3/t14-,17+,18+/m1/s1
InChIKey CAZPCXOBTRSCEL-JLSDUUJJSA-N
Mol Weight 332.37 g/mol
Molecular Formula C19H21FO4
Exact Mass 332.142387 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JSyvw8mSGpi
Name 3-Deoxy-3-fluoro-4-o-benzyl-5-o-benzoyl-D-xylitol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 332.142387315 u
Formula C19H21FO4
InChI InChI=1S/C19H21FO4/c1-14(21)18(20)17(23-12-15-8-4-2-5-9-15)13-24-19(22)16-10-6-3-7-11-16/h2-11,14,17-18,21H,12-13H2,1H3/t14-,17+,18+/m1/s1
InChIKey CAZPCXOBTRSCEL-JLSDUUJJSA-N
Molecular Weight 332.371 g/mol
SMILES [C@](O)(C)([C@](F)([C@@](OCC1=CC=CC=C1)(COC(=O)C1=CC=CC=C1)[H])[H])[H]