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1,2,3,5-tetra-O-acetyl-6-deoxy-4-O-methylhexitol-1-d
SpectraBase Compound ID 9AxYPJsxjIV
InChI InChI=1S/C15H24O9/c1-8(22-10(3)17)14(20-6)15(24-12(5)19)13(23-11(4)18)7-21-9(2)16/h8,13-15H,7H2,1-6H3/t8-,13-,14+,15+/m1/s1/i7D/t7-,8-,13-,14+,15+
InChIKey RFXIEGDQYAXMAV-ODTOLHMNSA-N
Mol Weight 349.35 g/mol
Molecular Formula C15H23DO9
Exact Mass 349.148309 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1JZxXaH1Rlz
Name 1,2,3,5-tetra-O-acetyl-6-deoxy-4-O-methylhexitol-1-d
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H23DO9
InChI InChI=1S/C15H24O9/c1-8(22-10(3)17)14(20-6)15(24-12(5)19)13(23-11(4)18)7-21-9(2)16/h8,13-15H,7H2,1-6H3/t8-,13-,14+,15+/m1/s1/i7D/t7-,8-,13-,14+,15+
InChIKey RFXIEGDQYAXMAV-ODTOLHMNSA-N
Instrument Name Agilent 7820A GC
Ionization Type EI
Literature Reference DOI 10.1021/np200472p
Molecular Weight 349.354 g/mol
SMILES [C@]([D])([C@]([C@@]([C@]([C@@](C)(OC(C)=O)[H])(OC)[H])(OC(C)=O)[H])(OC(C)=O)[H])(OC(C)=O)[H]
SPLASH splash10-0016-9810000000-cce0b75f7ce602831a85
Source of Spectrum G4-74-2162-2162-2
Wiley ID 1849029