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N-(1)-(4,5-DIHYDRO-3-H-1-BENZAZEPIN-2-YL)-NORSPERMINE_HYDROCHLORIDE;BZAZ_3,3,3
SpectraBase Compound ID CsISCqd7GZC
InChI InChI=1S/C19H29Cl4N5/c20-24-11-4-12-26(21)13-5-14-27(22)15-6-16-28(23)19-10-3-8-17-7-1-2-9-18(17)25-19/h1-2,7,9,24H,3-6,8,10-16H2
InChIKey CKKFOHZYARNJMY-UHFFFAOYSA-N
Mol Weight 469.3 g/mol
Molecular Formula C19H29Cl4N5
Exact Mass 467.117707 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BJqhlvfaGdP
Name N-(1)-(4,5-DIHYDRO-3-H-1-BENZAZEPIN-2-YL)-NORSPERMINE_HYDROCHLORIDE;BZAZ_3,3,3
Compound Number 21
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H29Cl4N5
InChI InChI=1S/C19H29Cl4N5/c20-24-11-4-12-26(21)13-5-14-27(22)15-6-16-28(23)19-10-3-8-17-7-1-2-9-18(17)25-19/h1-2,7,9,24H,3-6,8,10-16H2
InChIKey CKKFOHZYARNJMY-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 469.285 g/mol
Solvent D2O
Source File Reference UWMZ47598