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5-Nitro-1-N,3-N-bis(2-phenoxyethyl)benzene-1,3-dicarboxamide

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 MS (GC)

5-Nitro-1-N,3-N-bis(2-phenoxyethyl)benzene-1,3-dicarboxamide
SpectraBase Compound ID zHoZPkgC0g
InChI InChI=1S/C24H23N3O6/c28-23(25-11-13-32-21-7-3-1-4-8-21)18-15-19(17-20(16-18)27(30)31)24(29)26-12-14-33-22-9-5-2-6-10-22/h1-10,15-17H,11-14H2,(H,25,28)(H,26,29)
InChIKey MSICLLJJNBVACS-UHFFFAOYSA-N
Mol Weight 449.46 g/mol
Molecular Formula C24H23N3O6
Exact Mass 449.158685 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JsrUb6B4cAx
Name 5-Nitro-1-N,3-N-bis(2-phenoxyethyl)benzene-1,3-dicarboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 449.158685467 u
Formula C24H23N3O6
InChI InChI=1S/C24H23N3O6/c28-23(25-11-13-32-21-7-3-1-4-8-21)18-15-19(17-20(16-18)27(30)31)24(29)26-12-14-33-22-9-5-2-6-10-22/h1-10,15-17H,11-14H2,(H,25,28)(H,26,29)
InChIKey MSICLLJJNBVACS-UHFFFAOYSA-N
Molecular Weight 449.463 g/mol
SMILES C=1C=CC(OCCNC(C=2C=C(N(=O)=O)C=C(C(=O)NCCOC=3C=CC=CC3)C2)=O)=CC1