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2B;[CIS-4,5,7,8,10,11,19A,20,21,22,23,23A,32,33,35,36,38,39-OCTADECAHYDRO-13,17:26,30-DIMETHENOBENZO-[F1]-DINAPHTO-[2,1-K:1',2'-M]-[1,4,7,10,15,18,21,24,31,34]
SpectraBase Compound ID 2QrRNerA6fj
InChI InChI=1S/C52H54N2O10.2O.U/c1-3-13-41-37(9-1)19-21-45-49(41)50-42-14-4-2-10-38(42)20-22-46(50)60-32-28-56-24-26-58-30-34-62-48-18-8-12-40-36-54(64-52(40)48)44-16-6-5-15-43(44)53-35-39-11-7-17-47(51(39)63-53)61-33-29-57-25-23-55-27-31-59-45;;;/h1-4,7-14,17-22,35-36,43-44H,5-6,15-16,23-34H2;;;
InChIKey NGYGCDDDDNYNCA-UHFFFAOYSA-N
Mol Weight 1137.0 g/mol
Molecular Formula C52H54N2O12U
Exact Mass 1136.418465 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8BLpKPhKQrD
Name 2B;[CIS-4,5,7,8,10,11,19A,20,21,22,23,23A,32,33,35,36,38,39-OCTADECAHYDRO-13,17:26,30-DIMETHENOBENZO-[F1]-DINAPHTO-[2,1-K:1',2'-M]-[1,4,7,10,15,18,21,24,31,34]
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C52H54N2O12U
InChI InChI=1S/C52H54N2O10.2O.U/c1-3-13-41-37(9-1)19-21-45-49(41)50-42-14-4-2-10-38(42)20-22-46(50)60-32-28-56-24-26-58-30-34-62-48-18-8-12-40-36-54(64-52(40)48)44-16-6-5-15-43(44)53-35-39-11-7-17-47(51(39)63-53)61-33-29-57-25-23-55-27-31-59-45;;;/h1-4,7-14,17-22,35-36,43-44H,5-6,15-16,23-34H2;;;
InChIKey NGYGCDDDDNYNCA-UHFFFAOYSA-N
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 1137.036 g/mol
Solvent CDCl3
Source File Reference UWRK1066