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3-(2-DEOXY-BETA-D-ERYTHRO-PENTOFURANOSYL)-TETRAHYDRO-2,4,6-TRIOXO-1,3,5-TRIAZINE-1(2H)-CARBOXIMIDAMIDE
SpectraBase Compound ID 639Y4JmrLcd
InChI InChI=1S/C9H13N5O6/c10-6(11)14-8(18)12-7(17)13(9(14)19)5-1-3(16)4(2-15)20-5/h3-5,15-16H,1-2H2,(H3,10,11)(H,12,17,18)/t3-,4+,5+/m1/s1
InChIKey IBCPGTKDBCSSGG-WISUUJSJSA-N
Mol Weight 287.23 g/mol
Molecular Formula C9H13N5O6
Exact Mass 287.086583 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F1WtD1Padc7
Name 3-(2-DEOXY-BETA-D-ERYTHRO-PENTOFURANOSYL)-TETRAHYDRO-2,4,6-TRIOXO-1,3,5-TRIAZINE-1(2H)-CARBOXIMIDAMIDE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H13N5O6
InChI InChI=1S/C9H13N5O6/c10-6(11)14-8(18)12-7(17)13(9(14)19)5-1-3(16)4(2-15)20-5/h3-5,15-16H,1-2H2,(H3,10,11)(H,12,17,18)/t3-,4+,5+/m1/s1
InChIKey IBCPGTKDBCSSGG-WISUUJSJSA-N
Literature Reference Author S.RAOUL,J.CADET
Literature Reference Citation J.AM.CHEM.SOC.,118,1892(1996)
Literature Reference DOI 10.1021/ja952347l
Molecular Weight 287.232 g/mol
Sample ID 38322
Solvent DMSO-D6