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5-methyl-6-nitro-2-(trifluoromethyl)-1H-[1,2,4]triazolo[5,1-b]pyrimidin-7-one
SpectraBase Compound ID GwnMWfqYlZs
InChI InChI=1S/C7H4F3N5O3/c1-2-3(15(17)18)4(16)14-6(11-2)12-5(13-14)7(8,9)10/h1H3,(H,11,12,13)
InChIKey CYTBPGKQBBFHSR-UHFFFAOYSA-N
Mol Weight 263.14 g/mol
Molecular Formula C7H4F3N5O3
Exact Mass 263.026623 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 63YxFxTqrlx
Name 5-methyl-6-nitro-2-(trifluoromethyl)-1H-[1,2,4]triazolo[5,1-b]pyrimidin-7-one
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H4F3N5O3
InChI InChI=1S/C7H4F3N5O3/c1-2-3(15(17)18)4(16)14-6(11-2)12-5(13-14)7(8,9)10/h1H3,(H,11,12,13)
InChIKey CYTBPGKQBBFHSR-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 263.136 g/mol
Source File Reference MHKO5008