Wiley SpectraBase; SpectraBase Compound ID=14NfNPac8r SpectraBase Spectrum ID=JWQtsvICbrE
http://spectrabase.com/spectrum/JWQtsvICbrE (accessed Sep 20, 2020).

2,4,6,8,10,12-HEXA-(2'-FLUORO-PHENYLMETHYL)-2,4,6,8,10,12-HEXAAZA-TETRACYCLO-[5.5.0(5,9).0(3,11)]-DODECANE
SpectraBase Compound ID 14NfNPac8r
InChI InChI=1S/C48H42F6N6/c49-37-19-7-1-13-31(37)25-55-43-44-56(26-32-14-2-8-20-38(32)50)47(55)48-57(27-33-15-3-9-21-39(33)51)45(59(43)29-35-17-5-11-23-41(35)53)46(58(48)28-34-16-4-10-22-40(34)52)60(44)30-36-18-6-12-24-42(36)54/h1-24,43-48H,25-30H2/t43-,44+,45+,46-,47+,48-
InChIKey ZPDGBWGLRLMLIH-YIEHJZNPSA-N
Mol Weight 816.9 g/mol
Molecular Formula C48H42F6N6
Exact Mass 816.337515 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JWQtsvICbrE
SpectraBase Batch ID GjwZPqghGqg
Name 2,4,6,8,10,12-HEXA-(2'-FLUORO-PHENYLMETHYL)-2,4,6,8,10,12-HEXAAZA-TETRACYCLO-[5.5.0(5,9).0(3,11)]-DODECANE
Compound Number 3G
Copyright Copyright © 1980, 1981-2020 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C48H42F6N6/c49-37-19-7-1-13-31(37)25-55-43-44-56(26-32-14-2-8-20-38(32)50)47(55)48-57(27-33-15-3-9-21-39(33)51)45(59(43)29-35-17-5-11-23-41(35)53)46(58(48)28-34-16-4-10-22-40(34)52)60(44)30-36-18-6-12-24-42(36)54/h1-24,43-48H,25-30H2/t43-,44+,45+,46-,47+,48-
InChIKey ZPDGBWGLRLMLIH-YIEHJZNPSA-N
Literature Reference M.R.CRAMPTON,J.HAMID,R.MILLAR,G.FERGUSON J.CHEM.SOC.PERKIN-2,923(1993)
Solvent Chloroform-d
SpectraBase Compound ID 14NfNPac8r