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2-(3,4-Dimethoxyphenyl)-7-hydroxy-4-chromanone

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

2-(3,4-Dimethoxyphenyl)-7-hydroxy-4-chromanone
SpectraBase Compound ID 3iWbAnfeRpa
InChI InChI=1S/C17H16O5/c1-20-14-6-3-10(7-17(14)21-2)15-9-13(19)12-5-4-11(18)8-16(12)22-15/h3-8,15,18H,9H2,1-2H3
InChIKey KLCYWRUDTJXBQK-UHFFFAOYSA-N
Mol Weight 300.31 g/mol
Molecular Formula C17H16O5
Exact Mass 300.099774 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 4jSdYBMNoHd
Name 2-(3,4-Dimethoxyphenyl)-7-hydroxy-4-chromanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 300.099773610 u
Formula C17H16O5
InChI InChI=1S/C17H16O5/c1-20-14-6-3-10(7-17(14)21-2)15-9-13(19)12-5-4-11(18)8-16(12)22-15/h3-8,15,18H,9H2,1-2H3
InChIKey KLCYWRUDTJXBQK-UHFFFAOYSA-N
SMILES C12=C(OC(CC2=O)C2=CC(=C(C=C2)OC)OC)C=C(C=C1)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.92931