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Hexaacetyl-mannitol
SpectraBase Compound ID HYCdi8I3hbz
InChI InChI=1S/C18H26O12/c1-8(20)16(28,15(27)14(26)7-19)18(11(4)23,30-13(6)25)17(9(2)21,10(3)22)29-12(5)24/h14-15,19,26-28H,7H2,1-6H3/t14-,15-,16+,18+/m1/s1
InChIKey NDDQEWGZXXFTFE-CBZIJGRNSA-N
Mol Weight 434.39 g/mol
Molecular Formula C18H26O12
Exact Mass 434.142426 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KvDF5d0POoO
Name Hexaacetyl-mannitol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26O12
InChI InChI=1S/C18H26O12/c1-8(20)16(28,15(27)14(26)7-19)18(11(4)23,30-13(6)25)17(9(2)21,10(3)22)29-12(5)24/h14-15,19,26-28H,7H2,1-6H3/t14-,15-,16+,18+/m1/s1
InChIKey NDDQEWGZXXFTFE-CBZIJGRNSA-N
Molecular Weight 434.394 g/mol
SMILES O[C@@]([C@]([C@]([C@@](C(OC(=O)C)(C(=O)C)C(=O)C)(OC(=O)C)C(=O)C)(C(=O)C)O)(O)[H])(CO)[H]
SPLASH splash10-0006-9300000000-a5d517f050beea9b2f7d
Source of Spectrum HE-1986-337-0
Synonyms (4S,5S)-3,4-diacetyl-3-(acetyloxy)-5-hydroxy-2,6-dioxo-5-[(1R,2R)-1,2,3-trihydroxypropyl]heptan-4-yl acetate Acetic acid[(2S,3S,4R,5R)-2-acetoxy-1,1,2,3-tetraacetyl-3,4,5,6-tetrahydroxy-hexyl]ester Acetic acid[(4S,5S,6R,7R)-3,4,5-triacetyl-4-acetyloxy-5,6,7,8-tetrahydroxy-2-oxooctan-3-yl]ester [(2S,3S,4R,5R)-2-acetoxy-1,1,2,3-tetraacetyl-3,4,5,6-tetrahydroxy-hexyl]acetate [(4S,5S,6R,7R)-3,4,5-triacetyl-4-acetyloxy-5,6,7,8-tetrahydroxy-2-oxooctan-3-yl]acetate [(4S,5S,6R,7R)-4-acetyloxy-3,4,5-triethanoyl-5,6,7,8-tetrakis(oxidanyl)-2-oxidanylidene-octan-3-yl]ethanoate
Wiley ID 1382826