SpectraBase Compound ID | Isabpq0T0vf |
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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 |
SpectraBase Spectrum ID | ASURobMKMJv |
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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 |