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Isosorbide
SpectraBase Compound ID HlOFDns2EV1
InChI InChI=1S/C6H10O4/c7-3-1-9-6-4(8)2-10-5(3)6/h3-8H,1-2H2/t3-,4+,5-,6-/m1/s1
InChIKey KLDXJTOLSGUMSJ-JGWLITMVSA-N
Mol Weight 146.14 g/mol
Molecular Formula C6H10O4
Exact Mass 146.057909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IqzaxKuOQ1i
Name (3R,3aR,6S,6aR)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3,6-diol
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Exact Mass 146.057908798 u
Formula C6H10O4
InChI InChI=1S/C6H10O4/c7-3-1-9-6-4(8)2-10-5(3)6/h3-8H,1-2H2/t3-,4+,5-,6-/m1/s1
InChIKey KLDXJTOLSGUMSJ-JGWLITMVSA-N
Instrument Name GCMS
Ionization Type EI
Quality 1000
SMILES O[C@@]1([C@@]2([C@@]([C@@](CO2)(O)[H])(OC1)[H])[H])[H]
SPLASH splash10-052u-9000000000-7eab8b2fac055fedf076
Source of Spectrum WO2016099789A1
Wiley ID 1892653