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YWFSEUNVALGDLG-YOJNDSNFSA-L
SpectraBase Compound ID 1mecDmwguVn
InChI InChI=1S/2C21H21NO2.Be/c2*1-22(2)19-14-12-17(13-15-19)8-6-7-11-20(23)16-21(24)18-9-4-3-5-10-18;/h2*3-16,23H,1-2H3;/q;;+2/p-2/b2*8-6+,11-7+,20-16-;
InChIKey YWFSEUNVALGDLG-YOJNDSNFSA-L
Mol Weight 645.8 g/mol
Molecular Formula C42H40BeN2O4
Exact Mass 645.310991 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID PfDeAWB1VJ
Name YWFSEUNVALGDLG-YOJNDSNFSA-L
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H40BeN2O4
InChI InChI=1S/2C21H21NO2.Be/c2*1-22(2)19-14-12-17(13-15-19)8-6-7-11-20(23)16-21(24)18-9-4-3-5-10-18;/h2*3-16,23H,1-2H3;/q;;+2/p-2/b2*8-6+,11-7+,20-16-;
InChIKey YWFSEUNVALGDLG-YOJNDSNFSA-L
Literature Reference Author K.GUSTAV,U.BARTSCH,W.GUENTHER
Literature Reference Citation MH.CHEM.,125,1321(1994)
Literature Reference DOI 10.1007/BF00811081
Molecular Weight 645.803 g/mol
Solvent DMSO-D6
Source File Reference UWSK2568