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2-Chloro-6-fluorobenzaldehyde [5-(trifluoromethyl)-2-pyridinyl]hydrazone
SpectraBase Compound ID AuBOb4skfms
InChI InChI=1S/C13H8ClF4N3/c14-10-2-1-3-11(15)9(10)7-20-21-12-5-4-8(6-19-12)13(16,17)18/h1-7H,(H,19,21)/b20-7+
InChIKey GVDGYWUEQAISFE-IFRROFPPSA-N
Mol Weight 317.67 g/mol
Molecular Formula C13H8ClF4N3
Exact Mass 317.034288 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EPNcCSfa9a5
Name 2-Chloro-6-fluorobenzaldehyde [5-(trifluoromethyl)-2-pyridinyl]hydrazone
Comments Computed using HOSE algorithm
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Exact Mass 317.034287622 u
Formula C13H8ClF4N3
InChI InChI=1S/C13H8ClF4N3/c14-10-2-1-3-11(15)9(10)7-20-21-12-5-4-8(6-19-12)13(16,17)18/h1-7H,(H,19,21)/b20-7+
InChIKey GVDGYWUEQAISFE-IFRROFPPSA-N
Molecular Weight 317.675 g/mol
SMILES N(\N=C\C=1C(F)=CC=CC1Cl)C=1C=CC(C(F)(F)F)=CN1