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Mesoporphyrin-ii 3,3'-(4,4'-bipyridine-2,2'-diyl)dipropyl diester

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Mesoporphyrin-ii 3,3'-(4,4'-bipyridine-2,2'-diyl)dipropyl diester
SpectraBase Compound ID 1H2CjgugqEz
InChI InChI=1S/C50H54N6O4/c1-7-37-29(3)41-27-47-40-14-16-50(58)60-22-10-12-36-24-34(18-20-52-36)33-17-19-51-35(23-33)11-9-21-59-49(57)15-13-39-31(5)43(25-45(37)53-41)55-48(39)28-42-30(4)38(8-2)46(54-42)26-44(56-47)32(40)6/h17-20,23-28,55-56H,7-16,21-22H2,1-6H3/b41-27-,42-28-,43-25-,44-26?,45-25-,46-26?,47-27-,48-28-
InChIKey AYODIKUCVDPBFE-DAMRJLMYSA-N
Mol Weight 803.0 g/mol
Molecular Formula C50H54N6O4
Exact Mass 802.420654 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1VjMimVwr2k
Name Mesoporphyrin-ii 3,3'-(4,4'-bipyridine-2,2'-diyl)dipropyl diester
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C50H54N6O4
InChI InChI=1S/C50H54N6O4/c1-7-37-29(3)41-27-47-40-14-16-50(58)60-22-10-12-36-24-34(18-20-52-36)33-17-19-51-35(23-33)11-9-21-59-49(57)15-13-39-31(5)43(25-45(37)53-41)55-48(39)28-42-30(4)38(8-2)46(54-42)26-44(56-47)32(40)6/h17-20,23-28,55-56H,7-16,21-22H2,1-6H3/b41-27-,42-28-,43-25-,44-26?,45-25-,46-26?,47-27-,48-28-
InChIKey AYODIKUCVDPBFE-DAMRJLMYSA-N
Instrument Name Bruker WM-250
Literature Reference P. Leighton, J.K. Sanders, J. Chem. Soc. Perkin I 2385 (1987).
NMR Standard CD2Cl2
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD2Cl2