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3,6-Bis(4-methoxyphenyl)-4,5-bis(4-methoxyphenylcarbonyl)pyridazine
SpectraBase Compound ID F9jt5SY2HJz
InChI InChI=1S/C34H28N2O6/c1-39-25-13-5-21(6-14-25)31-29(33(37)23-9-17-27(41-3)18-10-23)30(34(38)24-11-19-28(42-4)20-12-24)32(36-35-31)22-7-15-26(40-2)16-8-22/h5-20H,1-4H3
InChIKey RTMHRHOXJOVVNY-UHFFFAOYSA-N
Mol Weight 560.6 g/mol
Molecular Formula C34H28N2O6
Exact Mass 560.194737 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dlu03D6pUce
Name 3,6-bis(4-Methoxyphenyl)-4,5-bis(4-methoxyphenylcarbonyl)pyridazine
Comments Computed using HOSE algorithm
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Exact Mass 560.194736624 u
Formula C34H28N2O6
InChI InChI=1S/C34H28N2O6/c1-39-25-13-5-21(6-14-25)31-29(33(37)23-9-17-27(41-3)18-10-23)30(34(38)24-11-19-28(42-4)20-12-24)32(36-35-31)22-7-15-26(40-2)16-8-22/h5-20H,1-4H3
InChIKey RTMHRHOXJOVVNY-UHFFFAOYSA-N
Molecular Weight 560.606 g/mol
SMILES C1(=C(C(C2=CC=C(C=C2)OC)=NN=C1C=1C=CC(=CC1)OC)C(C1=CC=C(C=C1)OC)=O)C(C=1C=CC(=CC1)OC)=O