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5-TRIFLUOROMETHYL-6-NITRO-7-OXO--4,7-DIHYDRO--1,2,4-TRIAZOLO[1,5-A]PYRIMIDINE

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5-TRIFLUOROMETHYL-6-NITRO-7-OXO--4,7-DIHYDRO--1,2,4-TRIAZOLO[1,5-A]PYRIMIDINE
SpectraBase Compound ID F6q6WZyJH6q
InChI InChI=1S/C6H2F3N5O3/c7-6(8,9)3-2(14(16)17)4(15)13-5(12-3)10-1-11-13/h1H,(H,10,11,12)
InChIKey JKTRZIGHTFYKJA-UHFFFAOYSA-N
Mol Weight 249.11 g/mol
Molecular Formula C6H2F3N5O3
Exact Mass 249.010973 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E3CHVf5cXqA
Name 5-TRIFLUOROMETHYL-6-NITRO-7-OXO--4,7-DIHYDRO--1,2,4-TRIAZOLO[1,5-A]PYRIMIDINE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H2F3N5O3
InChI InChI=1S/C6H2F3N5O3/c7-6(8,9)3-2(14(16)17)4(15)13-5(12-3)10-1-11-13/h1H,(H,10,11,12)
InChIKey JKTRZIGHTFYKJA-UHFFFAOYSA-N
Instrument Name Bruker WH-90
Literature Reference M.N.KUSHNIR, V.L.RUSINOV, E.N.ULOMSKY, N.A.KLYUEV, S.V.SHORSHNEV,G.G.ALEKSANDROV, O.N.CHUPAKHIN (1993) Zhurn.Org.Khim.(Russ. Lang.): v.29, N3,629-638.
NMR Standard C4H8O2
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C2D6SO dimethylsulfo