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1-O-Benzoylpentitol
SpectraBase Compound ID GHZlDBdmkTD
InChI InChI=1S/C12H16O6/c13-6-9(14)11(16)10(15)7-18-12(17)8-4-2-1-3-5-8/h1-5,9-11,13-16H,6-7H2/t9-,10+,11+/m1/s1
InChIKey ZLYKUAXFSIWLHE-VWYCJHECSA-N
Mol Weight 256.25 g/mol
Molecular Formula C12H16O6
Exact Mass 256.094688 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2gAjkKT0eyh
Name 1-O-Benzoylpentitol
Alternate Name(s) 2,3,4,5-tetrahydroxypentyl benzoate 2,3,4,5-tetrakis(oxidanyl)pentyl benzoate benzoic acid 2,3,4,5-tetrahydroxypentyl ester DL-Xylitol, 1-benzoate
CAS Registry Number 74793-68-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O6
InChI InChI=1S/C12H16O6/c13-6-9(14)11(16)10(15)7-18-12(17)8-4-2-1-3-5-8/h1-5,9-11,13-16H,6-7H2/t9-,10+,11+/m1/s1
InChIKey ZLYKUAXFSIWLHE-VWYCJHECSA-N
Molecular Weight 256.254 g/mol
SMILES OC[C@]([C@@]([C@@](O)(COC(=O)c1ccccc1)[H])(O)[H])(O)[H]
SPLASH splash10-0a4i-7900000000-35f969d8bb5c34ec18a5
Source of Spectrum HE-1982-0-0
Wiley ID 1259400