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2-Chloro-N-[2-(3,4-diethoxy-phenyl)-ethyl]-5-nitro-benzamide

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

2-Chloro-N-[2-(3,4-diethoxy-phenyl)-ethyl]-5-nitro-benzamide
SpectraBase Compound ID HRYo6Eqnzcz
InChI InChI=1S/C19H21ClN2O5/c1-3-26-17-8-5-13(11-18(17)27-4-2)9-10-21-19(23)15-12-14(22(24)25)6-7-16(15)20/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,21,23)
InChIKey HKPKJBTWVAIYTP-UHFFFAOYSA-N
Mol Weight 392.84 g/mol
Molecular Formula C19H21ClN2O5
Exact Mass 392.113899 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DsAxzeclAbv
Name 2-Chloro-N-[2-(3,4-diethoxy-phenyl)-ethyl]-5-nitro-benzamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 392.113899479 u
Formula C19H21ClN2O5
InChI InChI=1S/C19H21ClN2O5/c1-3-26-17-8-5-13(11-18(17)27-4-2)9-10-21-19(23)15-12-14(22(24)25)6-7-16(15)20/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,21,23)
InChIKey HKPKJBTWVAIYTP-UHFFFAOYSA-N
Molecular Weight 392.839 g/mol
SMILES CCOC1=CC(CCNC(C2=CC(N(=O)=O)=CC=C2Cl)=O)=CC=C1OCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.893346