![5-[4-[3-(2,3,5-TRI-O-BENZOYL-BETA-D-RIBOXYLOXY)-PROPYLOXY]-PHENYL]-10,15,20-TRITOLYLPORPHYRINE](/api/spectrum/JQN0Js29M1J/structure.png?h=300&w=458 "5-[4-[3-(2,3,5-TRI-O-BENZOYL-BETA-D-RIBOXYLOXY)-PROPYLOXY]-PHENYL]-10,15,20-TRITOLYLPORPHYRINE")
| SpectraBase Compound ID | 1CzHimdzqpI |
|---|---|
| InChI | InChI=1S/C76H62N4O9/c1-47-20-26-50(27-21-47)67-58-36-38-60(77-58)68(51-28-22-48(2)23-29-51)62-40-42-64(79-62)70(65-43-41-63(80-65)69(61-39-37-59(67)78-61)52-30-24-49(3)25-31-52)53-32-34-57(35-33-53)84-44-13-45-85-76-72(89-75(83)56-18-11-6-12-19-56)71(88-74(82)55-16-9-5-10-17-55)66(87-76)46-86-73(81)54-14-7-4-8-15-54/h4-12,14-43,66,71-72,76-77,80H,13,44-46H2,1-3H3/b67-58-,67-59-,68-60-,68-62-,69-61-,69-63-,70-64-,70-65-/t66-,71-,72-,76-/m1/s1 |
| InChIKey | QKKWQKZARKFSJP-ZCTCHITESA-N |
| Mol Weight | 1175.4 g/mol |
| Molecular Formula | C76H62N4O9 |
| Exact Mass | 1174.45168 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JQN0Js29M1J |
|---|---|
| Name | 5-[4-[3-(2,3,5-TRI-O-BENZOYL-BETA-D-RIBOXYLOXY)-PROPYLOXY]-PHENYL]-10,15,20-TRITOLYLPORPHYRINE |
| Compound Number | 1 3B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C76H62N4O9 |
| InChI | InChI=1S/C76H62N4O9/c1-47-20-26-50(27-21-47)67-58-36-38-60(77-58)68(51-28-22-48(2)23-29-51)62-40-42-64(79-62)70(65-43-41-63(80-65)69(61-39-37-59(67)78-61)52-30-24-49(3)25-31-52)53-32-34-57(35-33-53)84-44-13-45-85-76-72(89-75(83)56-18-11-6-12-19-56)71(88-74(82)55-16-9-5-10-17-55)66(87-76)46-86-73(81)54-14-7-4-8-15-54/h4-12,14-43,66,71-72,76-77,80H,13,44-46H2,1-3H3/b67-58-,67-59-,68-60-,68-62-,69-61-,69-63-,70-64-,70-65-/t66-,71-,72-,76-/m1/s1 |
| InChIKey | QKKWQKZARKFSJP-ZCTCHITESA-N |
| Literature Reference Author | O.GAUD,R.GRANET,M.KAOUADJI,P.KRAUSZ,J.C.BLAIS,G.BOLBACH |
| Literature Reference Citation | CAN.J.CHEM.,74,481(1996) |
| Literature Reference DOI | 10.1139/v96-053 |
| Molecular Weight | 1175.350 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRK3191 |