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2(4)-ETHYL-4(2)-HYDROXYMETHYL-DEUTEROPORPHYRIN-DIMETHYLESTER

View entire compound with spectra: 1 NMR

2(4)-ETHYL-4(2)-HYDROXYMETHYL-DEUTEROPORPHYRIN-DIMETHYLESTER
SpectraBase Compound ID JJ3Dfss971R
InChI InChI=1S/C35H40N4O5/c1-8-22-18(2)26-13-27-19(3)23(9-11-34(41)43-6)31(37-27)16-32-24(10-12-35(42)44-7)20(4)28(38-32)15-33-25(17-40)21(5)29(39-33)14-30(22)36-26/h13-16,36,38,40H,8-12,17H2,1-7H3/b26-13-,27-13-,28-15-,29-14-,30-14-,31-16-,32-16-,33-15-
InChIKey PLQMXNZPMQJZOL-NBLLDXTRSA-N
Mol Weight 596.7 g/mol
Molecular Formula C35H40N4O5
Exact Mass 596.29987 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9Q4wmtmMtqq
Name 2(4)-ETHYL-4(2)-HYDROXYMETHYL-DEUTEROPORPHYRIN-DIMETHYLESTER
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H40N4O5
InChI InChI=1S/C35H40N4O5/c1-8-22-18(2)26-13-27-19(3)23(9-11-34(41)43-6)31(37-27)16-32-24(10-12-35(42)44-7)20(4)28(38-32)15-33-25(17-40)21(5)29(39-33)14-30(22)36-26/h13-16,36,38,40H,8-12,17H2,1-7H3/b26-13-,27-13-,28-15-,29-14-,30-14-,31-16-,32-16-,33-15-
InChIKey PLQMXNZPMQJZOL-NBLLDXTRSA-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 596.726 g/mol
Solvent Unknown
Source File Reference UWVN7717