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3,8-Bis(2-chloro-ethyl)-13,17-bis(2-methoxycarbonyl-ethyl)-2,7,12,18-tetramethyl-porphyrine
SpectraBase Compound ID 2RSEHcsU4pD
InChI InChI=1S/C36H40Cl2N4O4/c1-19-23(7-9-35(43)45-5)33-18-34-24(8-10-36(44)46-6)20(2)29(42-34)16-32-26(12-14-38)22(4)30(41-32)17-31-25(11-13-37)21(3)28(39-31)15-27(19)40-33/h15-18,39,42H,7-14H2,1-6H3/b27-15-,28-15-,29-16-,30-17-,31-17-,32-16-,33-18-,34-18-
InChIKey RMKLCZCSKWOSEQ-SHWYJLMRSA-N
Mol Weight 663.6 g/mol
Molecular Formula C36H40Cl2N4O4
Exact Mass 662.242661 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2YteFrAL1Hd
Name 3,8-Bis(2-chloro-ethyl)-13,17-bis(2-methoxycarbonyl-ethyl)-2,7,12,18-tetramethyl-porphyrine
CAS Registry Number 31896-99-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C36H40Cl2N4O4
InChI InChI=1S/C36H40Cl2N4O4/c1-19-23(7-9-35(43)45-5)33-18-34-24(8-10-36(44)46-6)20(2)29(42-34)16-32-26(12-14-38)22(4)30(41-32)17-31-25(11-13-37)21(3)28(39-31)15-27(19)40-33/h15-18,39,42H,7-14H2,1-6H3/b27-15-,28-15-,29-16-,30-17-,31-17-,32-16-,33-18-,34-18-
InChIKey RMKLCZCSKWOSEQ-SHWYJLMRSA-N
Instrument Name Varian XL-100
Literature Reference A.R. Battersby, G.L. Hodgson, M.Ihara, J. Chem. Soc. Perkin I 2923 (1973).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3