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BIS-[2(4)-ACETYL-DEUTEROPORPHYRIN-DIMETHYLESTER]-4(2)-ETHYLAMINO
SpectraBase Compound ID DAqhIjqzSlv
InChI InChI=1S/C72H79N9O10/c1-33-45(17-21-65(84)88-13)57-31-59-47(19-23-67(86)90-15)35(3)51(76-59)27-61-69(37(5)55(78-61)29-63-71(43(11)82)39(7)53(80-63)25-49(33)74-57)41(9)73-42(10)70-38(6)56-30-64-72(44(12)83)40(8)54(81-64)26-50-34(2)46(18-22-66(85)89-14)58(75-50)32-60-48(20-24-68(87)91-16)36(4)52(77-60)28-62(70)79-56/h25-32,41-42,73,76-77,80-81H,17-24H2,1-16H3/b49-25-,50-26-,51-27-,52-28-,53-25-,54-26-,55-29-,56-30-,57-31-,58-32-,59-31-,60-32-,61-27-,62-28-,63-29-,64-30-
InChIKey OSMMYKVHYZYDPK-BXKGDEHDSA-N
Mol Weight 1230.5 g/mol
Molecular Formula C72H79N9O10
Exact Mass 1229.59499 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KoERFJHRKjp
Name BIS-[2(4)-ACETYL-DEUTEROPORPHYRIN-DIMETHYLESTER]-4(2)-ETHYLAMINO
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C72H79N9O10
InChI InChI=1S/C72H79N9O10/c1-33-45(17-21-65(84)88-13)57-31-59-47(19-23-67(86)90-15)35(3)51(76-59)27-61-69(37(5)55(78-61)29-63-71(43(11)82)39(7)53(80-63)25-49(33)74-57)41(9)73-42(10)70-38(6)56-30-64-72(44(12)83)40(8)54(81-64)26-50-34(2)46(18-22-66(85)89-14)58(75-50)32-60-48(20-24-68(87)91-16)36(4)52(77-60)28-62(70)79-56/h25-32,41-42,73,76-77,80-81H,17-24H2,1-16H3/b49-25-,50-26-,51-27-,52-28-,53-25-,54-26-,55-29-,56-30-,57-31-,58-32-,59-31-,60-32-,61-27-,62-28-,63-29-,64-30-
InChIKey OSMMYKVHYZYDPK-BXKGDEHDSA-N
Literature Reference Author C.J.BYRNE,M.A.COOPER,P.A.COWLED,R.A.W.JOHNSTONE,L.MACKENZIE, L.V.MARSHALLSAY,I.K.
Literature Reference Citation AUSTR.J.CHEM.,57,1091(2004)
Literature Reference DOI 10.1071/CH04062
Molecular Weight 1230.474 g/mol
Solvent Unknown
Source File Reference UWVN7719