| 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
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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 |