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1,2,3,4,5-Penta-O-acetyl-6-O-methyl-d-mannitol
SpectraBase Compound ID JxcqgcGH5hq
InChI InChI=1S/C17H26O11/c1-9(18)24-8-15(26-11(3)20)17(28-13(5)22)16(27-12(4)21)14(7-23-6)25-10(2)19/h14-17H,7-8H2,1-6H3/t14-,15-,16-,17-/m1/s1
InChIKey OFLLMJLGIPARRK-QBPKDAKJSA-N
Mol Weight 406.38 g/mol
Molecular Formula C17H26O11
Exact Mass 406.147512 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7fJTIsIH2tr
Name 1,2,3,4,5-Penta-O-acetyl-6-O-methyl-d-mannitol
Alternate Name(s) Acetic acid [(2R,3R,4R,5R)-2,3,4,5-tetraacetyloxy-6-methoxyhexyl] ester [(2R,3R,4R,5R)-2,3,4,5-tetraacetyloxy-6-methoxyhexyl] acetate [(2R,3R,4R,5R)-2,3,4,5-tetraacetoxy-6-methoxy-hexyl] acetate [(2R,3R,4R,5R)-2,3,4,5-tetraacetyloxy-6-methoxy-hexyl] ethanoate
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Formula C17H26O11
InChI InChI=1S/C17H26O11/c1-9(18)24-8-15(26-11(3)20)17(28-13(5)22)16(27-12(4)21)14(7-23-6)25-10(2)19/h14-17H,7-8H2,1-6H3/t14-,15-,16-,17-/m1/s1
InChIKey OFLLMJLGIPARRK-QBPKDAKJSA-N
Molecular Weight 406.384 g/mol
SMILES [C@@]([C@@]([C@](OC(=O)C)(COC)[H])(OC(=O)C)[H])([C@](OC(=O)C)(COC(=O)C)[H])(OC(=O)C)[H]
SPLASH splash10-0006-9400000000-43aec91e11d8225f3e69
Source of Spectrum HE-1986-481-0
Wiley ID 1371951