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2-[4-[4-[META-(2-METHYLPROPANAMIDO)-PHENYL]-PIPERAZIN-1-YL]-BUTYL]-1,4-DIOXOPERHYDRO-PYRIDO-[1,2-A]-PYRAZINE
SpectraBase Compound ID GgO6LiPa3i3
InChI InChI=1S/C26H39N5O3/c1-20(2)25(33)27-21-8-7-9-22(18-21)29-16-14-28(15-17-29)11-5-6-12-30-19-24(32)31-13-4-3-10-23(31)26(30)34/h7-9,18,20,23H,3-6,10-17,19H2,1-2H3,(H,27,33)
InChIKey XJSOIXCGCRDOFR-UHFFFAOYSA-N
Mol Weight 469.6 g/mol
Molecular Formula C26H39N5O3
Exact Mass 469.30529 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8iOZUeoF8T6
Name 2-[4-[4-[META-(2-METHYLPROPANAMIDO)-PHENYL]-PIPERAZIN-1-YL]-BUTYL]-1,4-DIOXOPERHYDRO-PYRIDO-[1,2-A]-PYRAZINE
Compound Number 32
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H39N5O3
InChI InChI=1S/C26H39N5O3/c1-20(2)25(33)27-21-8-7-9-22(18-21)29-16-14-28(15-17-29)11-5-6-12-30-19-24(32)31-13-4-3-10-23(31)26(30)34/h7-9,18,20,23H,3-6,10-17,19H2,1-2H3,(H,27,33)
InChIKey XJSOIXCGCRDOFR-UHFFFAOYSA-N
Literature Reference Author M.L.LOPEZ-RODRIGUEZ,M.J.MORCILLO,E.FERNANDEZ,E.PORRAS,L.OREN SANZ,M.E.BENEYTEZ,J.
Literature Reference Citation J.MED.CHEM.,44,186(2001)
Literature Reference DOI 10.1021/jm000929u
Molecular Weight 469.627 g/mol
Sample ID 43850
Solvent CDCl3