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1,2,4,5-Tetra-O-acetyl-3,6-anhydrohexitol
SpectraBase Compound ID G04YduPSHcM
InChI InChI=1S/C14H20O9/c1-7(15)19-5-11(21-8(2)16)13-14(23-10(4)18)12(6-20-13)22-9(3)17/h11-14H,5-6H2,1-4H3/t11-,12-,13-,14-/m1/s1/i6D/t6-,11-,12-,13-,14-
InChIKey XYTVZFGQLPBQQL-XTIXOHHBSA-N
Mol Weight 333.31 g/mol
Molecular Formula C14H192DO9
Exact Mass 333.117009 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IXsKPDObaf6
Name 1,2,4,5-Tetra-O-acetyl-3,6-anhydrohexitol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H19DO9
InChI InChI=1S/C14H20O9/c1-7(15)19-5-11(21-8(2)16)13-14(23-10(4)18)12(6-20-13)22-9(3)17/h11-14H,5-6H2,1-4H3/t11-,12-,13-,14-/m1/s1/i6D/t6-,11-,12-,13-,14-
InChIKey XYTVZFGQLPBQQL-XTIXOHHBSA-N
Molecular Weight 333.311 g/mol
SMILES [C@]1([C@](O[C@@]([C@]1(OC(=O)C)[H])([2D])[H])([C@](OC(=O)C)(COC(=O)C)[H])[H])(OC(=O)C)[H]
SPLASH splash10-0006-9300000000-f79ba08df4f7b270001d
Wiley ID 1497976