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N~1~-{2-[4-(4-methylbenzoyl)-1-piperazinyl]ethyl}-N~2~-phenylethanediamide

View entire compound with spectra: 2 NMR

N~1~-{2-[4-(4-methylbenzoyl)-1-piperazinyl]ethyl}-N~2~-phenylethanediamide
SpectraBase Compound ID 2RMONju7gJJ
InChI InChI=1S/C22H26N4O3/c1-17-7-9-18(10-8-17)22(29)26-15-13-25(14-16-26)12-11-23-20(27)21(28)24-19-5-3-2-4-6-19/h2-10H,11-16H2,1H3,(H,23,27)(H,24,28)
InChIKey XAGBWYASSJOOHA-UHFFFAOYSA-N
Mol Weight 394.48 g/mol
Molecular Formula C22H26N4O3
Exact Mass 394.200491 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4XSebF426ay
Name N~1~-{2-[4-(4-Methylbenzoyl)-1-piperazinyl]ethyl}-N~2~-phenylethanediamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 394.200490710 u
Formula C22H26N4O3
InChI InChI=1S/C22H26N4O3/c1-17-7-9-18(10-8-17)22(29)26-15-13-25(14-16-26)12-11-23-20(27)21(28)24-19-5-3-2-4-6-19/h2-10H,11-16H2,1H3,(H,23,27)(H,24,28)
InChIKey XAGBWYASSJOOHA-UHFFFAOYSA-N
Molecular Weight 394.475 g/mol
SMILES N(C(C(NC=1C=CC=CC1)=O)=O)CCN1CCN(C(C=2C=CC(=CC2)C)=O)CC1