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1-O-Octanoyl-d-xylitol

View entire compound with spectra: 1 MS (GC)

1-O-Octanoyl-d-xylitol
SpectraBase Compound ID JzWzO6hOyMO
InChI InChI=1S/C13H26O6/c1-2-3-4-5-6-7-12(17)19-9-11(16)13(18)10(15)8-14/h10-11,13-16,18H,2-9H2,1H3/t10-,11+,13+/m1/s1
InChIKey WATKJWBYOFPDLW-MDZLAQPJSA-N
Mol Weight 278.34 g/mol
Molecular Formula C13H26O6
Exact Mass 278.172939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BFVPtcnhZ1h
Name 1-O-Octanoyl-d-xylitol
Alternate Name(s) 2,3,4,5-tetrahydroxypentyl octanoate 2,3,4,5-tetrakis(oxidanyl)pentyl octanoate caprylic acid 2,3,4,5-tetrahydroxypentyl ester Octanoic acid 2,3,4,5-tetrahydroxypentyl ester Xylitol, 1-O-octanoyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H26O6
InChI InChI=1S/C13H26O6/c1-2-3-4-5-6-7-12(17)19-9-11(16)13(18)10(15)8-14/h10-11,13-16,18H,2-9H2,1H3/t10-,11+,13+/m1/s1
InChIKey WATKJWBYOFPDLW-MDZLAQPJSA-N
Molecular Weight 278.345 g/mol
SMILES O[C@]([C@]([C@@](CO)(O)[H])(O)[H])(COC(CCCCCCC)=O)[H]
SPLASH splash10-056r-9400000000-0cfffaac5b2827478ee0
Wiley ID 1501937