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SECURAMINE-A

View entire compound with spectra: 1 NMR

SECURAMINE-A
SpectraBase Compound ID Etj7fZmNxSE
InChI InChI=1S/C20H20BrClN4O/c1-19(2)15(22)10-20-12(11-5-3-4-6-13(11)25-20)9-16(27)26(20)8-7-14-17(19)24-18(21)23-14/h3-8,12,15,25H,9-10H2,1-2H3,(H,23,24)/b8-7-
InChIKey RIOWJYUGPBYKPY-FPLPWBNLSA-N
Mol Weight 447.76 g/mol
Molecular Formula C20H20BrClN4O
Exact Mass 446.050902 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ADYTDAGrxsF
Name SECURAMINE-A
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H20BrClN4O
InChI InChI=1S/C20H20BrClN4O/c1-19(2)15(22)10-20-12(11-5-3-4-6-13(11)25-20)9-16(27)26(20)8-7-14-17(19)24-18(21)23-14/h3-8,12,15,25H,9-10H2,1-2H3,(H,23,24)/b8-7-
InChIKey RIOWJYUGPBYKPY-FPLPWBNLSA-N
Literature Reference Author L.RAHBAEK,U.ANTHONI,C.CHRISTOPHERSEN,P.H.NIELSEN,B.O.PETERSE N
Literature Reference Citation J.ORG.CHEM.,61,887(1996)
Literature Reference DOI 10.1021/jo951527a
Molecular Weight 447.762 g/mol
Solvent CDCl3
Source File Reference UWGE1606