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N-(1)-(7-AMINO-4,5-DIHYDRO-3-H-1-BENZAZEPIN-2-YL)-SPERMINE_HYDROCHLORIDE
SpectraBase Compound ID qM4rvCSEpq
InChI InChI=1S/C20H32Cl4N6/c21-26-10-4-13-28(22)11-1-2-12-29(23)14-5-15-30(24)20-7-3-6-17-16-18(25)8-9-19(17)27-20/h8-9,16,26H,1-7,10-15,25H2
InChIKey JRWIUNQMAALXMY-UHFFFAOYSA-N
Mol Weight 498.3 g/mol
Molecular Formula C20H32Cl4N6
Exact Mass 496.144256 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Icgle6XqWId
Name N-(1)-(7-AMINO-4,5-DIHYDRO-3-H-1-BENZAZEPIN-2-YL)-SPERMINE_HYDROCHLORIDE
Compound Number 29
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H32Cl4N6
InChI InChI=1S/C20H32Cl4N6/c21-26-10-4-13-28(22)11-1-2-12-29(23)14-5-15-30(24)20-7-3-6-17-16-18(25)8-9-19(17)27-20/h8-9,16,26H,1-7,10-15,25H2
InChIKey JRWIUNQMAALXMY-UHFFFAOYSA-N
Literature Reference Author S.TOMASI,J.RENAULT,B.MARTIN,S.DUHIEU,V.CEREC,M.LEROCH,P.URIA C,J.G.DELCROS
Literature Reference Citation J.MED.CHEM.,53,7647(2010)
Literature Reference DOI 10.1021/jm1007648
Molecular Weight 498.326 g/mol
Solvent D2O
Source File Reference UWMZ47597