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1,2,3,4,5,6-HEXA-O-ACETYLDULCITOL
SpectraBase Compound ID IlYmMJMRRuD
InChI InChI=1S/C18H26O12/c1-9(19)25-7-15(27-11(3)21)17(29-13(5)23)18(30-14(6)24)16(28-12(4)22)8-26-10(2)20/h15-18H,7-8H2,1-6H3/t15-,16+,17+,18-
InChIKey NJVBTKVPPOFGAT-FZDBZEDMSA-N
Mol Weight 434.39 g/mol
Molecular Formula C18H26O12
Exact Mass 434.142426 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AK4Wn4ohNAU
Name (2R,3S,4R,5S)-hexane-1,2,3,4,5,6-hexayl hexaacetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26O12
InChI InChI=1S/C18H26O12/c1-9(19)25-7-15(27-11(3)21)17(29-13(5)23)18(30-14(6)24)16(28-12(4)22)8-26-10(2)20/h15-18H,7-8H2,1-6H3/t15-,16+,17+,18-
InChIKey NJVBTKVPPOFGAT-FZDBZEDMSA-N
Molecular Weight 434.394 g/mol
SMILES C([C@@]([C@@]([C@@]([C@@](COC(C)=O)(OC(=O)C)[H])([H])OC(=O)C)([H])OC(=O)C)(OC(=O)C)[H])OC(C)=O
SPLASH splash10-0006-5920000000-f2b6d7dac2b34892fe16
Source of Spectrum Jian-yu He, et al. Carbohydrate Research, V.379, 2013, P.18-20
Wiley ID 1817194