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(E)-N2-5-METHYL-4-(2,2,2-TRICHLOROETHYL)-3-CYANOFUR-2-YL-N1-(PARA-ACETYLPHENYL)FORMAMIDINE (ISOMER 1)
SpectraBase Compound ID 3vGTRIyKbwv
InChI InChI=1S/C17H14Cl3N3O2/c1-10(24)12-3-5-13(6-4-12)22-9-23-16-15(8-21)14(11(2)25-16)7-17(18,19)20/h3-6,9H,7H2,1-2H3,(H,22,23)
InChIKey LPIXAAJOBQPAPC-UHFFFAOYSA-N
Mol Weight 398.68 g/mol
Molecular Formula C17H14Cl3N3O2
Exact Mass 397.01516 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GrN1hzib0Ro
Name (E)-N2-5-METHYL-4-(2,2,2-TRICHLOROETHYL)-3-CYANOFUR-2-YL-N1-(PARA-ACETYLPHENYL)FORMAMIDINE (ISOMER 1)
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Formula C17H14Cl3N3O2
InChI InChI=1S/C17H14Cl3N3O2/c1-10(24)12-3-5-13(6-4-12)22-9-23-16-15(8-21)14(11(2)25-16)7-17(18,19)20/h3-6,9H,7H2,1-2H3,(H,22,23)
InChIKey LPIXAAJOBQPAPC-UHFFFAOYSA-N
Instrument Name Bruker AM-300
Literature Reference D.M.ANTONOV, L.I.BELEN'KY, V.S.BOGDANOV, A.A.DUDINOV, M.M.KRAYUSHKIN,V.N.NESTEROV, YU.T.STRUCHKOV, B.I.UGRAK (1992) Khim.Heteroc.Soed.(Russ. Lang.):N11, 1451-1460.
NMR Standard DMSO-D6
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C2D6SO dimethylsulfo