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3-METHYL-5-TRIFLUOROMETHYL-6-NITRO-7-OXO--3,7-DIHYDRO--1,2,4-TRIAZOLO[1,5-A]PYRIMIDINE
SpectraBase Compound ID AkmTqcn1NfP
InChI InChI=1S/C7H4F3N5O3/c1-13-2-11-14-5(16)3(15(17)18)4(7(8,9)10)12-6(13)14/h2H,1H3
InChIKey FZYXVMQALBKKJC-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 LHhpBvzSu69
Name 3-METHYL-5-TRIFLUOROMETHYL-6-NITRO-7-OXO--3,7-DIHYDRO--1,2,4-TRIAZOLO[1,5-A]PYRIMIDINE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H4F3N5O3
InChI InChI=1S/C7H4F3N5O3/c1-13-2-11-14-5(16)3(15(17)18)4(7(8,9)10)12-6(13)14/h2H,1H3
InChIKey FZYXVMQALBKKJC-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