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alpha-D-glucopyranose, 1,3,4,6-tetraacetate 2-nitrate
SpectraBase Compound ID 2w5GBX7kAvr
InChI InChI=1S/C14H19NO12/c1-6(16)22-5-10-11(23-7(2)17)12(24-8(3)18)13(27-15(20)21)14(26-10)25-9(4)19/h10-14H,5H2,1-4H3/t10-,11-,12+,13-,14+/m1/s1
InChIKey CVONMCQQSHJSQX-RGDJUOJXSA-N
Mol Weight 393.3 g/mol
Molecular Formula C14H19NO12
Exact Mass 393.090725 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C4LIg5UbkEH
Name alpha-D-Glucopyranose, 1,3,4,6-tetraacetate 2-nitrate
Comments Computed using HOSE algorithm
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Exact Mass 393.090725044 u
Formula C14H19NO12
InChI InChI=1S/C14H19NO12/c1-6(16)22-5-10-11(23-7(2)17)12(24-8(3)18)13(27-15(20)21)14(26-10)25-9(4)19/h10-14H,5H2,1-4H3/t10-,11-,12+,13-,14+/m1/s1
InChIKey CVONMCQQSHJSQX-RGDJUOJXSA-N
Molecular Weight 393.301 g/mol
SMILES [C@@]1(OC(=O)C)(O[C@@]([C@]([C@@]([C@]1(ON(=O)=O)[H])(OC(C)=O)[H])(OC(C)=O)[H])(COC(=O)C)[H])[H]