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N4-[3-(1-ALLYL-5-CHLORO-1H-3-PYRAZOLYL)-2-QUINOXALINYL]-N',N'-DIETHYL-1,4-PENTANEDIAMINE
SpectraBase Compound ID EM0t327hxfP
InChI InChI=1S/C23H31ClN6/c1-5-14-30-21(24)16-20(28-30)22-23(27-19-13-9-8-12-18(19)26-22)25-17(4)11-10-15-29(6-2)7-3/h5,8-9,12-13,16-17H,1,6-7,10-11,14-15H2,2-4H3,(H,25,27)
InChIKey XNVXJAUKSVCINN-UHFFFAOYSA-N
Mol Weight 427.0 g/mol
Molecular Formula C23H31ClN6
Exact Mass 426.229873 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B9ZdgxfMTKR
Name N4-[3-(1-ALLYL-5-CHLORO-1H-3-PYRAZOLYL)-2-QUINOXALINYL]-N',N'-DIETHYL-1,4-PENTANEDIAMINE
Compound Number 10D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H31ClN6
InChI InChI=1S/C23H31ClN6/c1-5-14-30-21(24)16-20(28-30)22-23(27-19-13-9-8-12-18(19)26-22)25-17(4)11-10-15-29(6-2)7-3/h5,8-9,12-13,16-17H,1,6-7,10-11,14-15H2,2-4H3,(H,25,27)
InChIKey XNVXJAUKSVCINN-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 426.992 g/mol
Solvent CDCl3
Source File Reference UWCP7585