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3-(3',4'-Dimethoxyphenyl)-4-methylcoumarin

View entire compound with spectra: 1 FTIR

3-(3',4'-Dimethoxyphenyl)-4-methylcoumarin
SpectraBase Compound ID 1Ec7Ww81aug
InChI InChI=1S/C18H16O4/c1-11-13-6-4-5-7-14(13)22-18(19)17(11)12-8-9-15(20-2)16(10-12)21-3/h4-10H,1-3H3
InChIKey XTQFXRPKOWXOQI-UHFFFAOYSA-N
Mol Weight 296.32 g/mol
Molecular Formula C18H16O4
Exact Mass 296.104859 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID t9tbMz6eZF
Name 3-(3',4'-Dimethoxyphenyl)-4-methylcoumarin
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 296.104858991 u
Formula C18H16O4
InChI InChI=1S/C18H16O4/c1-11-13-6-4-5-7-14(13)22-18(19)17(11)12-8-9-15(20-2)16(10-12)21-3/h4-10H,1-3H3
InChIKey XTQFXRPKOWXOQI-UHFFFAOYSA-N
SMILES CC=1C2=CC=CC=C2OC(C1C1=CC=C(C(=C1)OC)OC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.904812