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N-(5-CHLORO-2-HYDROXYPHENYL)-2,2'-BIS-[2-[2-[3-FORMYL-2-(2-PROPENYLOXY)-PHENOXY]-ETHOXY]-ETHOXY]-[1,1'-BINAPHTHALENE]-3-CARBOXAMIDE
SpectraBase Compound ID IQXyRw4UgKe
InChI InChI=1S/C55H50ClNO12/c1-3-23-67-52-39(35-58)13-9-17-48(52)65-30-26-62-25-29-64-47-22-19-37-11-5-7-15-42(37)50(47)51-43-16-8-6-12-38(43)33-44(55(61)57-45-34-41(56)20-21-46(45)60)54(51)69-32-28-63-27-31-66-49-18-10-14-40(36-59)53(49)68-24-4-2/h3-22,33-36,60H,1-2,23-32H2,(H,57,61)
InChIKey QYZKSYUFELBZLQ-UHFFFAOYSA-N
Mol Weight 952.5 g/mol
Molecular Formula C55H50ClNO12
Exact Mass 951.302154 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2kMetZIdyc7
Name N-(5-CHLORO-2-HYDROXYPHENYL)-2,2'-BIS-[2-[2-[3-FORMYL-2-(2-PROPENYLOXY)-PHENOXY]-ETHOXY]-ETHOXY]-[1,1'-BINAPHTHALENE]-3-CARBOXAMIDE
Compound Number 20C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C55H50ClNO12
InChI InChI=1S/C55H50ClNO12/c1-3-23-67-52-39(35-58)13-9-17-48(52)65-30-26-62-25-29-64-47-22-19-37-11-5-7-15-42(37)50(47)51-43-16-8-6-12-38(43)33-44(55(61)57-45-34-41(56)20-21-46(45)60)54(51)69-32-28-63-27-31-66-49-18-10-14-40(36-59)53(49)68-24-4-2/h3-22,33-36,60H,1-2,23-32H2,(H,57,61)
InChIKey QYZKSYUFELBZLQ-UHFFFAOYSA-N
Literature Reference Author A.M.REICHWEIN,W.VERBOOM,D.N.REINHOUDT
Literature Reference Citation REC.TR.CH.P.-B.,112,595(1993)
Literature Reference DOI 10.1002/recl.19931121106
Molecular Weight 952.454 g/mol
Solvent CDCl3
Source File Reference UWTS2499