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1-Amino-2-[(2-bis-ethoxycarbonylvinyl)amino]-4-chlorobenzene

View entire compound with spectra: 1 NMR, and 1 FTIR

1-Amino-2-[(2-bis-ethoxycarbonylvinyl)amino]-4-chlorobenzene
SpectraBase Compound ID 2r59Vr9RWet
InChI InChI=1S/C14H17ClN2O4/c1-3-20-13(18)10(14(19)21-4-2)8-17-12-7-9(15)5-6-11(12)16/h5-8,17H,3-4,16H2,1-2H3
InChIKey ZCCLBEYLOGUBHI-UHFFFAOYSA-N
Mol Weight 312.75 g/mol
Molecular Formula C14H17ClN2O4
Exact Mass 312.087685 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6k9zUCxOtxU
Name 1-Amino-2-[(2-bis-ethoxycarbonylvinyl)amino]-4-chlorobenzene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 312.087684731 u
Formula C14H17ClN2O4
InChI InChI=1S/C14H17ClN2O4/c1-3-20-13(18)10(14(19)21-4-2)8-17-12-7-9(15)5-6-11(12)16/h5-8,17H,3-4,16H2,1-2H3
InChIKey ZCCLBEYLOGUBHI-UHFFFAOYSA-N
Molecular Weight 312.753 g/mol
SMILES C1=C(C(=CC(=C1)Cl)NC=C(C(OCC)=O)C(OCC)=O)N
Spectrum/Structure Validation Score (Vapor Phase IR) 0.975746