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D-Fructose, 1-butanoate
SpectraBase Compound ID A44y5YOLRxM
InChI InChI=1S/C10H18O7/c1-2-3-8(14)17-5-7(13)10(16)9(15)6(12)4-11/h6,9-12,15-16H,2-5H2,1H3/t6-,9-,10-/m1/s1
InChIKey VFOMOCOFEDUPML-BDODKLCJSA-N
Mol Weight 250.25 g/mol
Molecular Formula C10H18O7
Exact Mass 250.105253 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5wuHPfHDJ2e
Name D-Fructose, 1-butanoate
Alternate Name(s) 1-O-butyryl-D-fructose 1-O-butyrylfructose
CAS Registry Number 123499-69-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O7
InChI InChI=1S/C10H18O7/c1-2-3-8(14)17-5-7(13)10(16)9(15)6(12)4-11/h6,9-12,15-16H,2-5H2,1H3/t6-,9-,10-/m1/s1
InChIKey VFOMOCOFEDUPML-BDODKLCJSA-N
Molecular Weight 250.247 g/mol
SMILES O[C@@]([C@]([C@@](C(COC(=O)CCC)=O)(O)[H])(O)[H])(CO)[H]
SPLASH splash10-000i-9210000000-f2c50541689dd3418043
Source of Spectrum KC-1989-1060-2
Wiley ID 1252726