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Dianhydromannitol
SpectraBase Compound ID FXF9MYFHSFJ
InChI InChI=1S/C6H10O4/c7-5-3-1-9-4(2-10-3)6(5)8/h3-8H,1-2H2/t3-,4-,5-,6-/m0/s1
InChIKey ZVYBPIWWKLWXPA-BXKVDMCESA-N
Mol Weight 146.14 g/mol
Molecular Formula C6H10O4
Exact Mass 146.057909 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2AIQ3v7Q2cJ
Name Dianhydromannitol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 146.057908798 u
Formula C6H10O4
InChI InChI=1S/C6H10O4/c7-5-3-1-9-4(2-10-3)6(5)8/h3-8H,1-2H2/t3-,4-,5-,6-/m0/s1
InChIKey ZVYBPIWWKLWXPA-BXKVDMCESA-N
SMILES [C@@]1([C@]([C@@]2(CO[C@]1(CO2)[H])[H])(O)[H])(O)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.960884