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5,10,15,20-Tetra(3,4,5-trimethoxyphenyl)-21H,23H-porphine

View entire compound with spectra: 1 NMR

5,10,15,20-Tetra(3,4,5-trimethoxyphenyl)-21H,23H-porphine
SpectraBase Compound ID 5HjesLcXF3d
InChI InChI=1S/C56H54N4O12/c1-61-41-21-29(22-42(62-2)53(41)69-9)49-33-13-15-35(57-33)50(30-23-43(63-3)54(70-10)44(24-30)64-4)37-17-19-39(59-37)52(32-27-47(67-7)56(72-12)48(28-32)68-8)40-20-18-38(60-40)51(36-16-14-34(49)58-36)31-25-45(65-5)55(71-11)46(26-31)66-6/h13-28,57,60H,1-12H3/b49-33-,49-34-,50-35-,50-37-,51-36-,51-38-,52-39-,52-40-
InChIKey WVYQOJACJYPRCF-ZNTHPLPZSA-N
Mol Weight 975.1 g/mol
Molecular Formula C56H54N4O12
Exact Mass 974.373823 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9FWkmufAjZf
Name 5,10,15,20-Tetra(3,4,5-trimethoxyphenyl)-21H,23H-porphine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 974.373823183 u
Formula C56H54N4O12
InChI InChI=1S/C56H54N4O12/c1-61-41-21-29(22-42(62-2)53(41)69-9)49-33-13-15-35(57-33)50(30-23-43(63-3)54(70-10)44(24-30)64-4)37-17-19-39(59-37)52(32-27-47(67-7)56(72-12)48(28-32)68-8)40-20-18-38(60-40)51(36-16-14-34(49)58-36)31-25-45(65-5)55(71-11)46(26-31)66-6/h13-28,57,60H,1-12H3/b49-33-,49-34-,50-35-,50-37-,51-36-,51-38-,52-39-,52-40-
InChIKey WVYQOJACJYPRCF-ZNTHPLPZSA-N
Molecular Weight 975.064 g/mol
SMILES C=12NC(=C(C3=NC(=C(C4=CC=C(C(=C5N=C(C1C1=CC(=C(C(=C1)OC)OC)OC)C=C5)C1=CC(=C(C(=C1)OC)OC)OC)N4)C1=CC(=C(C(=C1)OC)OC)OC)C=C3)C1=CC(=C(OC)C(=C1)OC)OC)C=C2