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4-O-Heptyl-d-glucitol
SpectraBase Compound ID 3SrgTVBAiuB
InChI InChI=1S/C13H28O6/c1-2-3-4-5-6-7-19-13(11(17)9-15)12(18)10(16)8-14/h10-18H,2-9H2,1H3/t10-,11+,12+,13+/m0/s1
InChIKey CQTRCOMFJOPYNS-UMSGYPCISA-N
Mol Weight 280.36 g/mol
Molecular Formula C13H28O6
Exact Mass 280.188589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B44JEakyqRO
Name 4-O-Heptyl-d-glucitol
Alternate Name(s) 4-Heptoxyhexane-1,2,3,5,6-pentol d-Glucitol, 4-O-heptyl-
CAS Registry Number 132591-05-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H28O6
InChI InChI=1S/C13H28O6/c1-2-3-4-5-6-7-19-13(11(17)9-15)12(18)10(16)8-14/h10-18H,2-9H2,1H3/t10-,11+,12+,13+/m0/s1
InChIKey CQTRCOMFJOPYNS-UMSGYPCISA-N
Molecular Weight 280.361 g/mol
SMILES OC[C@@]([C@]([C@@]([C@@](CO)(O)[H])(OCCCCCCC)[H])(O)[H])(O)[H]
SPLASH splash10-0abc-9200000000-f5defeede1529d051d12
Wiley ID 1495051