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2-{(2E)-2-[1-(4-bromophenyl)ethylidene]hydrazino}-6-methyl-4(3H)-pyrimidinone
SpectraBase Compound ID 3RZyArLWdYY
InChI InChI=1S/C13H13BrN4O/c1-8-7-12(19)16-13(15-8)18-17-9(2)10-3-5-11(14)6-4-10/h3-7H,1-2H3,(H2,15,16,18,19)/b17-9+
InChIKey SEDLFYSLBUWMND-RQZCQDPDSA-N
Mol Weight 321.18 g/mol
Molecular Formula C13H13BrN4O
Exact Mass 320.027274 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BU9Kt2vAm9y
Name 2-{(2E)-2-[1-(4-Bromophenyl)ethylidene]hydrazino}-6-methyl-4(3H)-pyrimidinone
Comments Computed using HOSE algorithm
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Exact Mass 320.027274054 u
Formula C13H13BrN4O
InChI InChI=1S/C13H13BrN4O/c1-8-7-12(19)16-13(15-8)18-17-9(2)10-3-5-11(14)6-4-10/h3-7H,1-2H3,(H2,15,16,18,19)/b17-9+
InChIKey SEDLFYSLBUWMND-RQZCQDPDSA-N
Molecular Weight 321.178 g/mol
SMILES N(\N=C\(C1=CC=C(C=C1)Br)C)C=1NC(C=C(N1)C)=O