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5,15-Bis(3-hydroxyphenyl)porphyrin
SpectraBase Compound ID E8cuBTWFFn9
InChI InChI=1S/C32H22N4O2/c37-25-5-1-3-19(15-25)31-27-11-7-21(33-27)17-23-9-13-29(35-23)32(20-4-2-6-26(38)16-20)30-14-10-24(36-30)18-22-8-12-28(31)34-22/h1-18,33,36-38H/b21-17-,22-18-,23-17-,24-18-,31-27-,31-28-,32-29-,32-30-
InChIKey DUUMHZSDMWUASS-DTEHSSGNSA-N
Mol Weight 494.6 g/mol
Molecular Formula C32H22N4O2
Exact Mass 494.174276 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 14xRI2Kny1i
Name 5,15-bis(3-Hydroxyphenyl)porphyrin
Comments Computed using HOSE algorithm
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Exact Mass 494.174275962 u
Formula C32H22N4O2
InChI InChI=1S/C32H22N4O2/c37-25-5-1-3-19(15-25)31-27-11-7-21(33-27)17-23-9-13-29(35-23)32(20-4-2-6-26(38)16-20)30-14-10-24(36-30)18-22-8-12-28(31)34-22/h1-18,33,36-38H/b21-17-,22-18-,23-17-,24-18-,31-27-,31-28-,32-29-,32-30-
InChIKey DUUMHZSDMWUASS-DTEHSSGNSA-N
Molecular Weight 494.554 g/mol
SMILES C12=C(C=3NC(C=C4N=C(C(=C5NC(=CC(=N2)C=C1)C=C5)C=1C=C(O)C=CC1)C=C4)=CC3)C=1C=C(O)C=CC1