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1,2,5-tri-O-acetyl-3,4-di-O-methylxylitol
SpectraBase Compound ID Ju3U66Pvat1
InChI InChI=1S/C13H22O8/c1-8(14)19-6-11(17-4)13(18-5)12(21-10(3)16)7-20-9(2)15/h11-13H,6-7H2,1-5H3/t11-,12+,13+/m1/s1
InChIKey ZKFWJYOWSSHOBN-AGIUHOORSA-N
Mol Weight 306.31 g/mol
Molecular Formula C13H22O8
Exact Mass 306.131468 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BvG107lBibp
Name 1,2,5-tri-O-acetyl-3,4-di-O-methylxylitol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 306.131467660 u
Formula C13H22O8
InChI InChI=1S/C13H22O8/c1-8(14)19-6-11(17-4)13(18-5)12(21-10(3)16)7-20-9(2)15/h11-13H,6-7H2,1-5H3/t11-,12+,13+/m1/s1
InChIKey ZKFWJYOWSSHOBN-AGIUHOORSA-N
Instrument Name TRIO-2 VG
Ionization Type EI
Literature Reference DOI 10.1021/np0106236
Molecular Weight 306.311 g/mol
Quality 8
SMILES C(OC(C)=O)[C@@]([C@@](OC)([C@@](COC(C)=O)(OC)[H])[H])(OC(C)=O)[H]
SPLASH splash10-014i-0900000000-752adb53c0515ffe6a45
Source of Spectrum G4-65-864-864-1 (DOI: 10.1021/np0106236)
Wiley ID 1894546