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5-(3-Methylbutyl)oxyflavone

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

5-(3-Methylbutyl)oxyflavone
SpectraBase Compound ID 3lO5ltDGDJ0
InChI InChI=1S/C20H20O3/c1-14(2)11-12-22-17-9-6-10-18-20(17)16(21)13-19(23-18)15-7-4-3-5-8-15/h3-10,13-14H,11-12H2,1-2H3
InChIKey MDEQFGXSTBGWOH-UHFFFAOYSA-N
Mol Weight 308.38 g/mol
Molecular Formula C20H20O3
Exact Mass 308.141245 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID qdGa3vdLuY
Name 5-(3-Methylbutyl)oxyflavone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 308.141244501 u
Formula C20H20O3
InChI InChI=1S/C20H20O3/c1-14(2)11-12-22-17-9-6-10-18-20(17)16(21)13-19(23-18)15-7-4-3-5-8-15/h3-10,13-14H,11-12H2,1-2H3
InChIKey MDEQFGXSTBGWOH-UHFFFAOYSA-N
Molecular Weight 308.377 g/mol
SMILES C1=CC=CC=C1C1=CC(C2=C(C=CC=C2OCCC(C)C)O1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.847406