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N4-[3-(1-BENZYL-5-CHLORO-1H-3-PYRAZOLYL)-2-QUINOXALINYL]-N',N'-DIETHYL-1,4-PENTANEDIAMINE
SpectraBase Compound ID 7u5jZGfZyZY
InChI InChI=1S/C27H33ClN6/c1-4-33(5-2)17-11-12-20(3)29-27-26(30-22-15-9-10-16-23(22)31-27)24-18-25(28)34(32-24)19-21-13-7-6-8-14-21/h6-10,13-16,18,20H,4-5,11-12,17,19H2,1-3H3,(H,29,31)
InChIKey SDCJIJQALOJCAJ-UHFFFAOYSA-N
Mol Weight 477.1 g/mol
Molecular Formula C27H33ClN6
Exact Mass 476.245523 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LLJa1ieCPTt
Name N4-[3-(1-BENZYL-5-CHLORO-1H-3-PYRAZOLYL)-2-QUINOXALINYL]-N',N'-DIETHYL-1,4-PENTANEDIAMINE
Compound Number 10C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H33ClN6
InChI InChI=1S/C27H33ClN6/c1-4-33(5-2)17-11-12-20(3)29-27-26(30-22-15-9-10-16-23(22)31-27)24-18-25(28)34(32-24)19-21-13-7-6-8-14-21/h6-10,13-16,18,20H,4-5,11-12,17,19H2,1-3H3,(H,29,31)
InChIKey SDCJIJQALOJCAJ-UHFFFAOYSA-N
Literature Reference Author B.MATUSZCZAK,K.MEREITER
Literature Reference Citation HETEROCYCLES,45,2449(1997)
Literature Reference DOI 10.3987/COM-97-7965
Molecular Weight 477.052 g/mol
Solvent CDCl3
Source File Reference UWCP7584