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4-[[4-(4-NITROPHENYL)-1H-1,2,3-TRIAZOL-1-YL]-METHYL]-PYRIMIDINE
SpectraBase Compound ID JVrCbmgJbv1
InChI InChI=1S/C13H10N6O2/c20-19(21)12-3-1-10(2-4-12)13-8-18(17-16-13)7-11-5-6-14-9-15-11/h1-6,8-9H,7H2
InChIKey LUAKJXJGGXGQJQ-UHFFFAOYSA-N
Mol Weight 282.26 g/mol
Molecular Formula C13H10N6O2
Exact Mass 282.086524 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HbyukHTOHUk
Name 4-[[4-(4-NITROPHENYL)-1H-1,2,3-TRIAZOL-1-YL]-METHYL]-PYRIMIDINE
Compound Number 5EM
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H10N6O2
InChI InChI=1S/C13H10N6O2/c20-19(21)12-3-1-10(2-4-12)13-8-18(17-16-13)7-11-5-6-14-9-15-11/h1-6,8-9H,7H2
InChIKey LUAKJXJGGXGQJQ-UHFFFAOYSA-N
Literature Reference Author A.BOLJE,D.URANKAR,J.KOSMRLJ
Literature Reference Citation EUR.J.ORG.CHEM.,2014,8167(2014)
Literature Reference DOI 10.1002/ejoc.201403100
Solvent DMSO-D6
Source File Reference UWIR18344