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5,10-Di(p-tolyl)porphyrin

View entire compound with spectra: 1 NMR, and 2 MS (GC)

5,10-Di(p-tolyl)porphyrin
SpectraBase Compound ID K2bYcEoS57r
InChI InChI=1S/C34H26N4/c1-21-3-7-23(8-4-21)33-29-15-13-27(36-29)19-25-11-12-26(35-25)20-28-14-16-30(37-28)34(32-18-17-31(33)38-32)24-9-5-22(2)6-10-24/h3-20,36-37H,1-2H3/b25-19-,26-20-,27-19-,28-20-,33-29-,33-31-,34-30-,34-32-
InChIKey JKBQBZLQDLDRFH-LDSDOGOMSA-N
Mol Weight 490.6 g/mol
Molecular Formula C34H26N4
Exact Mass 490.215747 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4seDjxOojLR
Name 5,10-di(p-Tolyl)porphyrin
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 490.215746853 u
Formula C34H26N4
InChI InChI=1S/C34H26N4/c1-21-3-7-23(8-4-21)33-29-15-13-27(36-29)19-25-11-12-26(35-25)20-28-14-16-30(37-28)34(32-18-17-31(33)38-32)24-9-5-22(2)6-10-24/h3-20,36-37H,1-2H3/b25-19-,26-20-,27-19-,28-20-,33-29-,33-31-,34-30-,34-32-
InChIKey JKBQBZLQDLDRFH-LDSDOGOMSA-N
Molecular Weight 490.610 g/mol
SMILES C1=2N=C(C(=C3NC(=CC4=NC(=CC=5NC(C2C2=CC=C(C=C2)C)=CC5)C=C4)C=C3)C2=CC=C(C=C2)C)C=C1