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Benzaldehyde, 4-methyl-, [4-[(3-bromophenyl)amino]-6-(4-morpholinyl)-1,3,5-triazin-2-yl]hydrazone
SpectraBase Compound ID 5kcUce9Mh9
InChI InChI=1S/C21H22BrN7O/c1-15-5-7-16(8-6-15)14-23-28-20-25-19(24-18-4-2-3-17(22)13-18)26-21(27-20)29-9-11-30-12-10-29/h2-8,13-14H,9-12H2,1H3,(H2,24,25,26,27,28)/b23-14+
InChIKey PAFAQEGOAPAWEK-OEAKJJBVSA-N
Mol Weight 468.36 g/mol
Molecular Formula C21H22BrN7O
Exact Mass 467.106921 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AxWp44xezOD
Name Benzaldehyde, 4-methyl-, [4-[(3-bromophenyl)amino]-6-(4-morpholinyl)-1,3,5-triazin-2-yl]hydrazone
Comments Computed using HOSE algorithm
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Exact Mass 467.106921355 u
Formula C21H22BrN7O
InChI InChI=1S/C21H22BrN7O/c1-15-5-7-16(8-6-15)14-23-28-20-25-19(24-18-4-2-3-17(22)13-18)26-21(27-20)29-9-11-30-12-10-29/h2-8,13-14H,9-12H2,1H3,(H2,24,25,26,27,28)/b23-14+
InChIKey PAFAQEGOAPAWEK-OEAKJJBVSA-N
Molecular Weight 468.359 g/mol
SMILES N(C1=NC(=NC(=N1)N1CCOCC1)N\N=C\C=1C=CC(=CC1)C)C1=CC(Br)=CC=C1