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1-[[1-(4-BROMOBENZYL)-1H-1,2,3-TRIAZOL-4-YL]-METHYL]-PYRIMIDINE-2,4-(1H,3H)-DIONE

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1-[[1-(4-BROMOBENZYL)-1H-1,2,3-TRIAZOL-4-YL]-METHYL]-PYRIMIDINE-2,4-(1H,3H)-DIONE
SpectraBase Compound ID DbSE6HBu6sn
InChI InChI=1S/C14H12BrN5O2/c15-11-3-1-10(2-4-11)7-20-9-12(17-18-20)8-19-6-5-13(21)16-14(19)22/h1-6,9H,7-8H2,(H,16,21,22)
InChIKey CCNFBXHDVSNCTQ-UHFFFAOYSA-N
Mol Weight 362.19 g/mol
Molecular Formula C14H12BrN5O2
Exact Mass 361.017438 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GUQPDx3wECu
Name 1-[[1-(4-BROMOBENZYL)-1H-1,2,3-TRIAZOL-4-YL]-METHYL]-PYRIMIDINE-2,4-(1H,3H)-DIONE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H12BrN5O2
InChI InChI=1S/C14H12BrN5O2/c15-11-3-1-10(2-4-11)7-20-9-12(17-18-20)8-19-6-5-13(21)16-14(19)22/h1-6,9H,7-8H2,(H,16,21,22)
InChIKey CCNFBXHDVSNCTQ-UHFFFAOYSA-N
Literature Reference Author R.GONZALEZ-OLVERA,A.ESPINOZA-VAZQUEZ,G.E.NEGRON-SILVA,M.E.PA LOMAR-PARDAVE
Literature Reference Citation MOLECULES,18,15064(2013)
Literature Reference DOI 10.3390/molecules181215064
Molecular Weight 362.186 g/mol
Solvent DMSO-D6
Source File Reference UWIR9940