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2A;[CIS-4,5,7,8,16A,17,18,19,20,20A,29,20,32,33-TETRADECAHYDRO-10,14:23,27-DIMETHENOBENZO-[Z]-DINAPHTO-[2,1-H:1',2'-J]-[1,4,7,12,15,18,25,28]-HEXAOXADIAZACYCLO
SpectraBase Compound ID EkYAxU7uU88
InChI InChI=1S/C48H48N2O8.2O.U/c51-47-35-11-7-17-43(47)57-29-25-53-23-27-55-41-21-19-33-9-1-3-13-37(33)45(41)46-38-14-4-2-10-34(38)20-22-42(46)56-28-24-54-26-30-58-44-18-8-12-36(48(44)52)32-50-40-16-6-5-15-39(40)49-31-35;;;/h1-4,7-14,17-22,31-32,39-40,51-52H,5-6,15-16,23-30H2;;;/q;;;+2/p-2/b49-31+,50-32+;;;/t39-,40+;;;
InChIKey KRXNVYKZAXTHEY-NXXNKLPSSA-L
Mol Weight 1048.9 g/mol
Molecular Formula C48H46N2O10U
Exact Mass 1048.366036 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HT6dH8NiSU5
Name 2A;[CIS-4,5,7,8,16A,17,18,19,20,20A,29,20,32,33-TETRADECAHYDRO-10,14:23,27-DIMETHENOBENZO-[Z]-DINAPHTO-[2,1-H:1',2'-J]-[1,4,7,12,15,18,25,28]-HEXAOXADIAZACYCLO
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H46N2O10U
InChI InChI=1S/C48H48N2O8.2O.U/c51-47-35-11-7-17-43(47)57-29-25-53-23-27-55-41-21-19-33-9-1-3-13-37(33)45(41)46-38-14-4-2-10-34(38)20-22-42(46)56-28-24-54-26-30-58-44-18-8-12-36(48(44)52)32-50-40-16-6-5-15-39(40)49-31-35;;;/h1-4,7-14,17-22,31-32,39-40,51-52H,5-6,15-16,23-30H2;;;/q;;;+2/p-2/b49-31+,50-32+;;;/t39-,40+;;;
InChIKey KRXNVYKZAXTHEY-NXXNKLPSSA-L
Literature Reference Author A.M.REICHWEIN,W.VERBOOM,D.N.REINHOUDT
Literature Reference Citation REC.TR.CH.P.-B.,112,358(1993)
Literature Reference DOI 10.1002/recl.19931120609
Molecular Weight 1048.930 g/mol
Solvent CDCl3
Source File Reference UWRK1065