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5-FLUORO-N-[4-O-(BETA-D-GLUCOPYRANOSYLURONIC-ACID)-3-NITROBENZYLOXYCARBONYL]-2,4-DIOXO-1,2,3,4-TETRAHYDROPYRIMIDIN-1-YL-METHYLAMINE

View entire compound with spectra: 1 NMR

5-FLUORO-N-[4-O-(BETA-D-GLUCOPYRANOSYLURONIC-ACID)-3-NITROBENZYLOXYCARBONYL]-2,4-DIOXO-1,2,3,4-TETRAHYDROPYRIMIDIN-1-YL-METHYLAMINE
SpectraBase Compound ID 301BnxG162o
InChI InChI=1S/C19H19FN4O13/c20-8-4-23(18(31)22-15(8)28)6-21-19(32)35-5-7-1-2-10(9(3-7)24(33)34)36-17-13(27)11(25)12(26)14(37-17)16(29)30/h1-4,11-14,17,25-27H,5-6H2,(H,21,32)(H,29,30)(H,22,28,31)/t11-,12-,13+,14-,17+/m1/s1
InChIKey ZXCYOUVNIGWZAI-MPZWGZMNSA-N
Mol Weight 530.37 g/mol
Molecular Formula C19H19FN4O13
Exact Mass 530.093265 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2uK6Zc2DlXC
Name 5-FLUORO-N-[4-O-(BETA-D-GLUCOPYRANOSYLURONIC-ACID)-3-NITROBENZYLOXYCARBONYL]-2,4-DIOXO-1,2,3,4-TETRAHYDROPYRIMIDIN-1-YL-METHYLAMINE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H19FN4O13
InChI InChI=1S/C19H19FN4O13/c20-8-4-23(18(31)22-15(8)28)6-21-19(32)35-5-7-1-2-10(9(3-7)24(33)34)36-17-13(27)11(25)12(26)14(37-17)16(29)30/h1-4,11-14,17,25-27H,5-6H2,(H,21,32)(H,29,30)(H,22,28,31)/t11-,12-,13+,14-,17+/m1/s1
InChIKey ZXCYOUVNIGWZAI-MPZWGZMNSA-N
Literature Reference Author R.MADEC-LOUGERSTAY,J.C.FLORENT,C.MONNERET
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1369(1999)
Literature Reference DOI 10.1039/a808915i
Molecular Weight 530.377 g/mol
Solvent D2O
Source File Reference UWRU5672