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ALPHA,OMEGA-DIAMINODODECYL-9,9'-BIS-(9-URETHANO-ACRIDINE)
SpectraBase Compound ID Isabpq0T0vf
InChI InChI=1S/C44H52N6O4/c1-3-53-43(51)47-31-23-25-39-35(29-31)41(33-19-13-15-21-37(33)49-39)45-27-17-11-9-7-5-6-8-10-12-18-28-46-42-34-20-14-16-22-38(34)50-40-26-24-32(30-36(40)42)48-44(52)54-4-2/h13-16,19-26,29-30H,3-12,17-18,27-28H2,1-2H3,(H,45,49)(H,46,50)(H,47,51)(H,48,52)
InChIKey XPEKSFHOFKWLMR-UHFFFAOYSA-N
Mol Weight 728.9 g/mol
Molecular Formula C44H52N6O4
Exact Mass 728.405004 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ASURobMKMJv
Name ALPHA,OMEGA-DIAMINODODECYL-9,9'-BIS-(9-URETHANO-ACRIDINE)
Compound Number 20C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C44H52N6O4
InChI InChI=1S/C44H52N6O4/c1-3-53-43(51)47-31-23-25-39-35(29-31)41(33-19-13-15-21-37(33)49-39)45-27-17-11-9-7-5-6-8-10-12-18-28-46-42-34-20-14-16-22-38(34)50-40-26-24-32(30-36(40)42)48-44(52)54-4-2/h13-16,19-26,29-30H,3-12,17-18,27-28H2,1-2H3,(H,45,49)(H,46,50)(H,47,51)(H,48,52)
InChIKey XPEKSFHOFKWLMR-UHFFFAOYSA-N
Literature Reference Author M.MOISAN,J.P.GALY,A.M.GALY,J.BARBE
Literature Reference Citation MH.CHEM.,124,23(1993)
Literature Reference DOI 10.1007/BF00808507
Molecular Weight 728.935 g/mol
Solvent TFAA-D
Source File Reference UWPB48