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1-O-Heptyl-d-mannitol
SpectraBase Compound ID 3LevvRPRk67
InChI InChI=1S/C13H28O6/c1-2-3-4-5-6-7-19-9-11(16)13(18)12(17)10(15)8-14/h10-18H,2-9H2,1H3/t10-,11-,12-,13-/m1/s1
InChIKey MJBRSBZDVJHYRW-FDYHWXHSSA-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 9NY2xj4IvFa
Name 1-O-Heptyl-d-mannitol
Alternate Name(s) 1-O-Heptyl-d-glucitol 6-O-Heptyl-d-glucitol d-Glucitol, 1-O-heptyl- 6-Heptoxyhexane-1,2,3,4,5-pentol d-Mannitol, 1-O-heptyl- Glucitol, 6-O-heptyl-
CAS Registry Number 126403-07-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H28O6
InChI InChI=1S/C13H28O6/c1-2-3-4-5-6-7-19-9-11(16)13(18)12(17)10(15)8-14/h10-18H,2-9H2,1H3/t10-,11-,12-,13-/m1/s1
InChIKey MJBRSBZDVJHYRW-FDYHWXHSSA-N
Molecular Weight 280.361 g/mol
SMILES O[C@@]([C@]([C@@]([C@@](CO)(O)[H])(O)[H])(O)[H])(COCCCCCCC)[H]
SPLASH splash10-05fu-9300000000-d3b7d4a2880c955b24f2
Source of Spectrum HE-1986-2353-0
Wiley ID 1283550