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benzaldehyde, 4-(dimethylamino)-, [(2Z)-4-oxo-5-[[3-(trifluoromethyl)phenyl]methyl]thiazolidinylidene]hydrazone
SpectraBase Compound ID AXmzwMbZWRP
InChI InChI=1S/C20H19F3N4OS/c1-27(2)16-8-6-13(7-9-16)12-24-26-19-25-18(28)17(29-19)11-14-4-3-5-15(10-14)20(21,22)23/h3-10,12,17H,11H2,1-2H3,(H,25,26,28)/b24-12+
InChIKey HOHXSXNINKFBBK-WYMPLXKRSA-N
Mol Weight 420.45 g/mol
Molecular Formula C20H19F3N4OS
Exact Mass 420.123167 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5HSUnwlmmIm
Name Benzaldehyde, 4-(dimethylamino)-, [(2Z)-4-oxo-5-[[3-(trifluoromethyl)phenyl]methyl]thiazolidinylidene]hydrazone
Comments Computed using HOSE algorithm
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Exact Mass 420.123166910 u
Formula C20H19F3N4OS
InChI InChI=1S/C20H19F3N4OS/c1-27(2)16-8-6-13(7-9-16)12-24-26-19-25-18(28)17(29-19)11-14-4-3-5-15(10-14)20(21,22)23/h3-10,12,17H,11H2,1-2H3,(H,25,26,28)/b24-12+
InChIKey HOHXSXNINKFBBK-WYMPLXKRSA-N
Molecular Weight 420.454 g/mol
SMILES N1C(C(S\C1=N\N=C\C1=CC=C(C=C1)N(C)C)CC1=CC(C(F)(F)F)=CC=C1)=O