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Methyl-2-deoxy-3,5-di-p-nitrobenzoyl-.beta.-D-erythropentoside

View entire compound with spectra: 1 NMR

Methyl-2-deoxy-3,5-di-p-nitrobenzoyl-.beta.-D-erythropentoside
SpectraBase Compound ID 5KUphGKfvvY
InChI InChI=1S/C20H18N2O10/c1-29-18-10-16(32-20(24)13-4-8-15(9-5-13)22(27)28)17(31-18)11-30-19(23)12-2-6-14(7-3-12)21(25)26/h2-9,16-18H,10-11H2,1H3
InChIKey NGKKKFKTIZCIEN-UHFFFAOYSA-N
Mol Weight 446.37 g/mol
Molecular Formula C20H18N2O10
Exact Mass 446.096145 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7ced1PGkXEb
Name Methyl-2-deoxy-3,5-di-p-nitrobenzoyl-.beta.-D-erythropentoside
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 446.096144778 u
Formula C20H18N2O10
InChI InChI=1S/C20H18N2O10/c1-29-18-10-16(32-20(24)13-4-8-15(9-5-13)22(27)28)17(31-18)11-30-19(23)12-2-6-14(7-3-12)21(25)26/h2-9,16-18H,10-11H2,1H3
InChIKey NGKKKFKTIZCIEN-UHFFFAOYSA-N
Molecular Weight 446.368 g/mol
SMILES C1=C(C=CC(=C1)C(=O)OC1C(OC(C1)OC)COC(C=1C=CC(=CC1)N(=O)=O)=O)N(=O)=O