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[N-(3,4-dimethoxyphenethyl)carbamoyl]coumarin

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

[N-(3,4-dimethoxyphenethyl)carbamoyl]coumarin
SpectraBase Compound ID BG2BTffmcQp
InChI InChI=1S/C20H19NO5/c1-24-17-8-7-13(11-18(17)25-2)9-10-21-19(22)15-12-14-5-3-4-6-16(14)26-20(15)23/h3-8,11-12H,9-10H2,1-2H3,(H,21,22)
InChIKey NIEDCQSASLGAKO-UHFFFAOYSA-N
Mol Weight 353.37 g/mol
Molecular Formula C20H19NO5
Exact Mass 353.126323 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 4mwUkPb1TJb
Name [N-(3,4-Dimethoxyphenethyl)carbamoyl]coumarin
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 353.126322711 u
Formula C20H19NO5
InChI InChI=1S/C20H19NO5/c1-24-17-8-7-13(11-18(17)25-2)9-10-21-19(22)15-12-14-5-3-4-6-16(14)26-20(15)23/h3-8,11-12H,9-10H2,1-2H3,(H,21,22)
InChIKey NIEDCQSASLGAKO-UHFFFAOYSA-N
Molecular Weight 353.374 g/mol
SMILES N(C(C=1C(OC=2C=CC=CC2C1)=O)=O)CCC=1C=C(C(=CC1)OC)OC
Spectrum/Structure Validation Score (Raman) 0.994179