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Coproporphyrin-ii tetramethyl ester

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Coproporphyrin-ii tetramethyl ester
SpectraBase Compound ID 1VaJY0Nfy7i
InChI InChI=1S/C40H46N4O8/c1-21-25(9-13-37(45)49-5)33-19-34-27(11-15-39(47)51-7)23(3)31(43-34)18-32-24(4)28(12-16-40(48)52-8)36(44-32)20-35-26(10-14-38(46)50-6)22(2)30(42-35)17-29(21)41-33/h17-20,41,44H,9-16H2,1-8H3/b29-17-,30-17-,31-18-,32-18-,33-19-,34-19-,35-20-,36-20-
InChIKey KIEMNPQCVHEDIL-PUQSVQPZSA-N
Mol Weight 710.8 g/mol
Molecular Formula C40H46N4O8
Exact Mass 710.331564 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3VZZsToQjqS
Name Coproporphyrin-ii tetramethyl ester
CAS Registry Number 865-16-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C40H46N4O8
InChI InChI=1S/C40H46N4O8/c1-21-25(9-13-37(45)49-5)33-19-34-27(11-15-39(47)51-7)23(3)31(43-34)18-32-24(4)28(12-16-40(48)52-8)36(44-32)20-35-26(10-14-38(46)50-6)22(2)30(42-35)17-29(21)41-33/h17-20,41,44H,9-16H2,1-8H3/b29-17-,30-17-,31-18-,32-18-,33-19-,34-19-,35-20-,36-20-
InChIKey KIEMNPQCVHEDIL-PUQSVQPZSA-N
Instrument Name Varian XL-100
Literature Reference R.J. Abraham, G.E. Hawkes, K.M.Smith, J. Chem. Soc. Perkin II 627 (1974).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3