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7,8-DIHYDRO-5,10,15,20-TETRAKIS-(3-HYDROXYPHENYL)-PORPHYRIN;5,10,15,20-TETRAKIS-(META-HYDROXYPHENYL)-CHLORIN
SpectraBase Compound ID 1aM9dhuLnaw
InChI InChI=1S/C44H32N4O4/c49-29-9-1-5-25(21-29)41-33-13-15-35(45-33)42(26-6-2-10-30(50)22-26)37-17-19-39(47-37)44(28-8-4-12-32(52)24-28)40-20-18-38(48-40)43(36-16-14-34(41)46-36)27-7-3-11-31(51)23-27/h1-17,19,21-24,45-46,49-52H,18,20H2/b41-33-,41-34-,42-35-,42-37-,43-36-,43-38-,44-39-,44-40-
InChIKey KSXLETNRCMCRAQ-LWQDQPMZSA-N
Mol Weight 680.8 g/mol
Molecular Formula C44H32N4O4
Exact Mass 680.242356 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DpHxusosjbu
Name 7,8-DIHYDRO-5,10,15,20-TETRAKIS-(3-HYDROXYPHENYL)-PORPHYRIN;5,10,15,20-TETRAKIS-(META-HYDROXYPHENYL)-CHLORIN
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C44H32N4O4
InChI InChI=1S/C44H32N4O4/c49-29-9-1-5-25(21-29)41-33-13-15-35(45-33)42(26-6-2-10-30(50)22-26)37-17-19-39(47-37)44(28-8-4-12-32(52)24-28)40-20-18-38(48-40)43(36-16-14-34(41)46-36)27-7-3-11-31(51)23-27/h1-17,19,21-24,45-46,49-52H,18,20H2/b41-33-,41-34-,42-35-,42-37-,43-36-,43-38-,44-39-,44-40-
InChIKey KSXLETNRCMCRAQ-LWQDQPMZSA-N
Literature Reference Author R.BONNETT,B.D.DJELAL,G.E.HAWKES,P.HAYCOCK,F.PONT
Literature Reference Citation J.CHEM.SOC.PERKIN-2,1839(1994)
Literature Reference DOI 10.1039/p29940001839
Molecular Weight 680.762 g/mol
Solvent DMSO-D6
Source File Reference UWRU4230