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Isosorbide-2,5-dinitrate
SpectraBase Compound ID JE45LYgoY0r
InChI InChI=1S/C6H8N2O8/c9-7(10)15-3-1-13-6-4(16-8(11)12)2-14-5(3)6/h3-6H,1-2H2/t3-,4+,5-,6-/m1/s1
InChIKey MOYKHGMNXAOIAT-JGWLITMVSA-N
Mol Weight 236.14 g/mol
Molecular Formula C6H8N2O8
Exact Mass 236.028065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8HuYLr7cl7A
Name Isosorbide-2,5-dinitrate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H8N2O8
InChI InChI=1S/C6H8N2O8/c9-7(10)15-3-1-13-6-4(16-8(11)12)2-14-5(3)6/h3-6H,1-2H2/t3-,4+,5-,6-/m1/s1
InChIKey MOYKHGMNXAOIAT-JGWLITMVSA-N
Molecular Weight 236.136 g/mol
SMILES [C@]1(ON(=O)=O)([C@@]2([C@]([C@](ON(=O)=O)(CO2)[H])([H])OC1)[H])[H]
SPLASH splash10-05mp-9100000000-e5e1ed15ce0c2902523a
Source of Spectrum SO-0-1033-1
Synonyms (3S,3aS,6R,6aS)-6-(nitrooxy)-hexahydrofuro[3,2-b]furan-3-yl nitrate Nitric acid[(3S,3aS,6R,6aS)-3-nitrooxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]ester [(3S,3aS,6R,6aS)-3-nitrooxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]nitrate [(3S,3aS,6R,6aS)-3-nitrooxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] nitrate
Wiley ID 1545192