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(2S,5S)-1,5-Bis(benzoyloxy)-2,6-hexanediol
SpectraBase Compound ID JCRHiHrFPJU
InChI InChI=1S/C20H22O6/c21-13-18(26-20(24)16-9-5-2-6-10-16)12-11-17(22)14-25-19(23)15-7-3-1-4-8-15/h1-10,17-18,21-22H,11-14H2/t17-,18-/m0/s1
InChIKey ZWEPREOGDUBIFU-ROUUACIJSA-N
Mol Weight 358.39 g/mol
Molecular Formula C20H22O6
Exact Mass 358.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AwVMxHBPN8D
Name (2S,5S)-1,5-Bis(benzoyloxy)-2,6-hexanediol
Alternate Name(s) 1,5-Di-O-benzoyl-3,4-dideoxy-D-threo-hexitol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22O6
InChI InChI=1S/C20H22O6/c21-13-18(26-20(24)16-9-5-2-6-10-16)12-11-17(22)14-25-19(23)15-7-3-1-4-8-15/h1-10,17-18,21-22H,11-14H2/t17-,18-/m0/s1
InChIKey ZWEPREOGDUBIFU-ROUUACIJSA-N
Molecular Weight 358.390 g/mol
SMILES O[C@@](CC[C@@](CO)(OC(=O)c1ccccc1)[H])(COC(=O)c1ccccc1)[H]
SPLASH splash10-0a4i-0920000000-10f4909b5a09c5bba5a0
Source of Spectrum SO-0-992-5
Wiley ID 1543605