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1-[4,6-DIMETHYL-1H-[1,2,3]-TRIAZOLO-[4,5-D]-PYRIMIDINE-5,7(4H,6H)-DIONE]-ACETYL-L-ALANYL-L-GLYCINE-METHYLESTER
SpectraBase Compound ID 39ZmAp1FQH3
InChI InChI=1S/C14H19N7O6/c1-7(12(24)15-5-9(23)27-4)16-8(22)6-21-10-11(17-18-21)19(2)14(26)20(3)13(10)25/h7H,5-6H2,1-4H3,(H,15,24)(H,16,22)/t7-/m1/s1
InChIKey WSCRCRUQMRWLAZ-SSDOTTSWSA-N
Mol Weight 381.35 g/mol
Molecular Formula C14H19N7O6
Exact Mass 381.139681 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H9kwN6s9k9Q
Name 1-[4,6-DIMETHYL-1H-[1,2,3]-TRIAZOLO-[4,5-D]-PYRIMIDINE-5,7(4H,6H)-DIONE]-ACETYL-L-ALANYL-L-GLYCINE-METHYLESTER
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H19N7O6
InChI InChI=1S/C14H19N7O6/c1-7(12(24)15-5-9(23)27-4)16-8(22)6-21-10-11(17-18-21)19(2)14(26)20(3)13(10)25/h7H,5-6H2,1-4H3,(H,15,24)(H,16,22)/t7-/m1/s1
InChIKey WSCRCRUQMRWLAZ-SSDOTTSWSA-N
Literature Reference Author A.A.H.ABDEL-RAHMAN
Literature Reference Citation MH.CHEM.,139,61(2008)
Literature Reference DOI 10.1007/s00706-007-0745-8
Molecular Weight 381.348 g/mol
Sample ID 39633
Solvent DMSO-D6