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1-O-Acetylfructose
SpectraBase Compound ID 4amIc11GrxD
InChI InChI=1S/C8H14O7/c1-4(10)15-3-6(12)8(14)7(13)5(11)2-9/h5,7-9,11,13-14H,2-3H2,1H3/t5-,7-,8-/m1/s1
InChIKey IRAYHVNRVMVXPR-LPBLVHEISA-N
Mol Weight 222.19 g/mol
Molecular Formula C8H14O7
Exact Mass 222.073953 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FOY0wLKh1YE
Name 1-O-Acetylfructose
CAS Registry Number 123499-76-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O7
InChI InChI=1S/C8H14O7/c1-4(10)15-3-6(12)8(14)7(13)5(11)2-9/h5,7-9,11,13-14H,2-3H2,1H3/t5-,7-,8-/m1/s1
InChIKey IRAYHVNRVMVXPR-LPBLVHEISA-N
Molecular Weight 222.193 g/mol
SMILES O[C@@]([C@]([C@@](C(COC(=O)C)=O)(O)[H])(O)[H])(CO)[H]
SPLASH splash10-00di-0890000000-a7affd563f381f1dc58d
Source of Spectrum KC-1989-1060-2
Synonyms 1-O-acetyl-D-fructose Acetic acid [(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl] ester [(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexyl] acetate [(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxo-hexyl] acetate [(3S,4R,5R)-3,4,5,6-tetrakis(oxidanyl)-2-oxidanylidene-hexyl] ethanoate
Wiley ID 1221723