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COMPLEX-CA(2+)

View entire compound with spectra: 1 NMR

COMPLEX-CA(2+)
SpectraBase Compound ID 2KJbDAF6ekb
InChI InChI=1S/C20H28N2O4.Ca/c23-19(21-11-5-1-6-12-21)15-25-17-9-3-4-10-18(17)26-16-20(24)22-13-7-2-8-14-22;/h3-4,9-10H,1-2,5-8,11-16H2;/q;+2
InChIKey NPIPDYXWHJYHHU-UHFFFAOYSA-N
Mol Weight 400.5 g/mol
Molecular Formula C20H28CaN2O4
Exact Mass 400.167498 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 268AkXd9dFX
Name COMPLEX-CA(2+)
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28CaN2O4
InChI InChI=1S/C20H28N2O4.Ca/c23-19(21-11-5-1-6-12-21)15-25-17-9-3-4-10-18(17)26-16-20(24)22-13-7-2-8-14-22;/h3-4,9-10H,1-2,5-8,11-16H2;/q;+2
InChIKey NPIPDYXWHJYHHU-UHFFFAOYSA-N
Literature Reference Author W.O.LIN,M.C.B.V.DESOUZA,H.G.ALT
Literature Reference Citation QUIM.NOVA,11,393(1988)
Molecular Weight 400.533 g/mol
Solvent ACETONE-D6
Source File Reference UWBT12616