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4-Propyloxy-7-methoxycoumarin

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

4-Propyloxy-7-methoxycoumarin
SpectraBase Compound ID KdAb9mYjrbS
InChI InChI=1S/C13H14O4/c1-3-6-16-11-8-13(14)17-12-7-9(15-2)4-5-10(11)12/h4-5,7-8H,3,6H2,1-2H3
InChIKey YDENCFRLJGFNEM-UHFFFAOYSA-N
Mol Weight 234.25 g/mol
Molecular Formula C13H14O4
Exact Mass 234.089209 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LZ30wcldDUf
Name 4-Propyloxy-7-methoxycoumarin
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 234.089208927 u
Formula C13H14O4
InChI InChI=1S/C13H14O4/c1-3-6-16-11-8-13(14)17-12-7-9(15-2)4-5-10(11)12/h4-5,7-8H,3,6H2,1-2H3
InChIKey YDENCFRLJGFNEM-UHFFFAOYSA-N
Molecular Weight 234.251 g/mol
SMILES C1(=CC=C2C(=C1)OC(=O)C=C2OCCC)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.910594