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5,15-Bis(3,4-dimethoxyphenyl)porphyrin

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5,15-Bis(3,4-dimethoxyphenyl)porphyrin
SpectraBase Compound ID 9JTQQceUA1w
InChI InChI=1S/C36H30N4O4/c1-41-31-15-5-21(17-33(31)43-3)35-27-11-7-23(37-27)19-25-9-13-29(39-25)36(22-6-16-32(42-2)34(18-22)44-4)30-14-10-26(40-30)20-24-8-12-28(35)38-24/h5-20,37,40H,1-4H3/b23-19-,24-20-,25-19-,26-20-,35-27-,35-28-,36-29-,36-30-
InChIKey UHYAIIBFERARHP-RIRTYBNCSA-N
Mol Weight 582.7 g/mol
Molecular Formula C36H30N4O4
Exact Mass 582.226705 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I4DDOpt5Smb
Name 5,15-bis(3,4-Dimethoxyphenyl)porphyrin
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 582.226705458 u
Formula C36H30N4O4
InChI InChI=1S/C36H30N4O4/c1-41-31-15-5-21(17-33(31)43-3)35-27-11-7-23(37-27)19-25-9-13-29(39-25)36(22-6-16-32(42-2)34(18-22)44-4)30-14-10-26(40-30)20-24-8-12-28(35)38-24/h5-20,37,40H,1-4H3/b23-19-,24-20-,25-19-,26-20-,35-27-,35-28-,36-29-,36-30-
InChIKey UHYAIIBFERARHP-RIRTYBNCSA-N
Molecular Weight 582.660 g/mol
SMILES C12=C(C=3NC(C=C4N=C(C(=C5NC(=CC(=N2)C=C1)C=C5)C=1C=C(OC)C(=CC1)OC)C=C4)=CC3)C=1C=C(OC)C(=CC1)OC