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SODIUM_SALT_OF_MESO_TETRA-(PARA-CARBOXYPHENYL)-PORPHYRIN
SpectraBase Compound ID 6dCpnCDjlp6
InChI InChI=1S/C48H30N4O8.4Na/c53-45(54)29-9-1-25(2-10-29)41-33-17-19-35(49-33)42(26-3-11-30(12-4-26)46(55)56)37-21-23-39(51-37)44(28-7-15-32(16-8-28)48(59)60)40-24-22-38(52-40)43(36-20-18-34(41)50-36)27-5-13-31(14-6-27)47(57)58;;;;/h1-24,49,52H,(H,53,54)(H,55,56)(H,57,58)(H,59,60);;;;/q;4*+1/p-4/b41-33-,41-34-,42-35-,42-37-,43-36-,43-38-,44-39-,44-40-;;;;
InChIKey QHXITUQHKRZJRX-GVHKZQBISA-J
Mol Weight 878.71507713 g/mol
Molecular Formula C48H26N4Na4O8
Exact Mass 878.134141 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CF7k7flazNc
Name SODIUM_SALT_OF_MESO_TETRA-(PARA-CARBOXYPHENYL)-PORPHYRIN
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H26N4Na4O8
InChI InChI=1S/C48H30N4O8.4Na/c53-45(54)29-9-1-25(2-10-29)41-33-17-19-35(49-33)42(26-3-11-30(12-4-26)46(55)56)37-21-23-39(51-37)44(28-7-15-32(16-8-28)48(59)60)40-24-22-38(52-40)43(36-20-18-34(41)50-36)27-5-13-31(14-6-27)47(57)58;;;;/h1-24,49,52H,(H,53,54)(H,55,56)(H,57,58)(H,59,60);;;;/q;4*+1/p-4/b41-33-,41-34-,42-35-,42-37-,43-36-,43-38-,44-39-,44-40-;;;;
InChIKey QHXITUQHKRZJRX-GVHKZQBISA-J
Literature Reference Author T.A.BABUSHKINA,G.V.PONOMAREV
Literature Reference Citation CHEM.HET.COMP.,34,474(1998)
Literature Reference DOI 10.1007/bf02290889
Molecular Weight 878.716 g/mol
Solvent D2O
Source File Reference UWMZ14512