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4,7-Dichloro-5,8,12,15-tetramethoxy-13,16-bis(4-[2-methoxycarbonylphenyl]butyl)(2.2)paracyclophane
SpectraBase Compound ID Iuua8czsoli
InChI InChI=1S/C44H50Cl2O8/c1-49-39-31(21-13-9-17-27-15-7-11-19-29(27)43(47)53-5)34-24-26-36-38(46)41(51-3)35(37(45)42(36)52-4)25-23-33(39)32(40(34)50-2)22-14-10-18-28-16-8-12-20-30(28)44(48)54-6/h7-8,11-12,15-16,19-20H,9-10,13-14,17-18,21-26H2,1-6H3
InChIKey MQGSFVYYUUSKCK-UHFFFAOYSA-N
Mol Weight 777.8 g/mol
Molecular Formula C44H50Cl2O8
Exact Mass 776.288274 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5huau1WDgb2
Name 4,7-Dichloro-5,8,12,15-tetramethoxy-13,16-bis(4-[2-methoxycarbonylphenyl]butyl)(2.2)paracyclophane
Comments BOND FROM C1 TO C14 COMPLETED (A.H.)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C44H50Cl2O8
InChI InChI=1S/C44H50Cl2O8/c1-49-39-31(21-13-9-17-27-15-7-11-19-29(27)43(47)53-5)34-24-26-36-38(46)41(51-3)35(37(45)42(36)52-4)25-23-33(39)32(40(34)50-2)22-14-10-18-28-16-8-12-20-30(28)44(48)54-6/h7-8,11-12,15-16,19-20H,9-10,13-14,17-18,21-26H2,1-6H3
InChIKey MQGSFVYYUUSKCK-UHFFFAOYSA-N
Instrument Name Bruker AM-500
Literature Reference R.E. Fischer, J. Dabrowski, A. Ejchart, Magn. Res. Chem. 26, 834 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3