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2,5-Diethylamino-3,6-dioxo-1,4-cyclohexadiene-1,4-dicarboxylic acid-bis(1'-piperidinylamide)

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

2,5-Diethylamino-3,6-dioxo-1,4-cyclohexadiene-1,4-dicarboxylic acid-bis(1'-piperidinylamide)
SpectraBase Compound ID BHLKBiZzLGO
InChI InChI=1S/C22H32N4O4/c1-3-23-17-15(21(29)25-11-7-5-8-12-25)20(28)18(24-4-2)16(19(17)27)22(30)26-13-9-6-10-14-26/h23-24H,3-14H2,1-2H3
InChIKey AQMXMQMDOCALIS-UHFFFAOYSA-N
Mol Weight 416.5 g/mol
Molecular Formula C22H32N4O4
Exact Mass 416.242356 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KpaQIlk2VN3
Name 2,5-Diethylamino-3,6-dioxo-1,4-cyclohexadiene-1,4-dicarboxylic acid-bis(1'-piperidinylamide)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 416.242355522 u
Formula C22H32N4O4
InChI InChI=1S/C22H32N4O4/c1-3-23-17-15(21(29)25-11-7-5-8-12-25)20(28)18(24-4-2)16(19(17)27)22(30)26-13-9-6-10-14-26/h23-24H,3-14H2,1-2H3
InChIKey AQMXMQMDOCALIS-UHFFFAOYSA-N
Molecular Weight 416.522 g/mol
SMILES C1(=C(C(=O)C(=C(C1=O)NCC)C(N1CCCCC1)=O)NCC)C(N1CCCCC1)=O