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4,4'-Methylenedicarbanilic acid, diethyl ester

View entire compound with spectra: 4 NMR, 2 FTIR, 1 Raman, and 2 MS (GC)

4,4'-Methylenedicarbanilic acid, diethyl ester
SpectraBase Compound ID JMmuG6n74PK
InChI InChI=1S/C19H22N2O4/c1-3-24-18(22)20-16-9-5-14(6-10-16)13-15-7-11-17(12-8-15)21-19(23)25-4-2/h5-12H,3-4,13H2,1-2H3,(H,20,22)(H,21,23)
InChIKey AXHTZVWDOXONQF-UHFFFAOYSA-N
Mol Weight 342.4 g/mol
Molecular Formula C19H22N2O4
Exact Mass 342.157957 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 9idacc5MfXH
Name 4,4'-Methylenedicarbanilic acid, diethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 342.157957192 u
Formula C19H22N2O4
InChI InChI=1S/C19H22N2O4/c1-3-24-18(22)20-16-9-5-14(6-10-16)13-15-7-11-17(12-8-15)21-19(23)25-4-2/h5-12H,3-4,13H2,1-2H3,(H,20,22)(H,21,23)
InChIKey AXHTZVWDOXONQF-UHFFFAOYSA-N
Molecular Weight 342.395 g/mol
SMILES N(C1=CC=C(CC=2C=CC(=CC2)NC(OCC)=O)C=C1)C(OCC)=O
Spectrum/Structure Validation Score (Raman) 0.920016