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N,N'-Ethylenebis(3-coumarincarboxamide)

View entire compound with spectra: 1 NMR, 1 FTIR, and 3 MS (GC)

N,N'-Ethylenebis(3-coumarincarboxamide)
SpectraBase Compound ID 9I5wn44ATBr
InChI InChI=1S/C22H16N2O6/c25-19(15-11-13-5-1-3-7-17(13)29-21(15)27)23-9-10-24-20(26)16-12-14-6-2-4-8-18(14)30-22(16)28/h1-8,11-12H,9-10H2,(H,23,25)(H,24,26)
InChIKey UEHSTGDQZXUEEQ-UHFFFAOYSA-N
Mol Weight 404.38 g/mol
Molecular Formula C22H16N2O6
Exact Mass 404.100836 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JRyJA9ZLDIA
Name N,N'-Ethylenebis(3-coumarincarboxamide)
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 404.100836237 u
Formula C22H16N2O6
InChI InChI=1S/C22H16N2O6/c25-19(15-11-13-5-1-3-7-17(13)29-21(15)27)23-9-10-24-20(26)16-12-14-6-2-4-8-18(14)30-22(16)28/h1-8,11-12H,9-10H2,(H,23,25)(H,24,26)
InChIKey UEHSTGDQZXUEEQ-UHFFFAOYSA-N
Molecular Weight 404.378 g/mol
SMILES C=1(C(OC=2C(C1)=CC=CC2)=O)C(=O)NCCNC(C=1C(OC=2C(C1)=CC=CC2)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.982844