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2-[(4-Bromobenzyl)oxy]benzaldehyde (4,6-dimethyl-2-pyrimidinyl)hydrazone
SpectraBase Compound ID 5MFXwND9lzZ
InChI InChI=1S/C20H19BrN4O/c1-14-11-15(2)24-20(23-14)25-22-12-17-5-3-4-6-19(17)26-13-16-7-9-18(21)10-8-16/h3-12H,13H2,1-2H3,(H,23,24,25)/b22-12+
InChIKey CKCGYGMBVJZSSU-WSDLNYQXSA-N
Mol Weight 411.3 g/mol
Molecular Formula C20H19BrN4O
Exact Mass 410.074224 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J9Y2xImpUDF
Name 2-[(4-Bromobenzyl)oxy]benzaldehyde (4,6-dimethyl-2-pyrimidinyl)hydrazone
Comments Computed using HOSE algorithm
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Exact Mass 410.074224247 u
Formula C20H19BrN4O
InChI InChI=1S/C20H19BrN4O/c1-14-11-15(2)24-20(23-14)25-22-12-17-5-3-4-6-19(17)26-13-16-7-9-18(21)10-8-16/h3-12H,13H2,1-2H3,(H,23,24,25)/b22-12+
InChIKey CKCGYGMBVJZSSU-WSDLNYQXSA-N
Molecular Weight 411.303 g/mol
SMILES N(\N=C\C=1C(OCC=2C=CC(=CC2)Br)=CC=CC1)C=1N=C(C)C=C(N1)C