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2,4-Dibenzoxy-6-methyl-phenol

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

2,4-Dibenzoxy-6-methyl-phenol
SpectraBase Compound ID DBYrKl38ibF
InChI InChI=1S/C21H20O3/c1-16-12-19(23-14-17-8-4-2-5-9-17)13-20(21(16)22)24-15-18-10-6-3-7-11-18/h2-13,22H,14-15H2,1H3
InChIKey WDJUSFQCCXXTIQ-UHFFFAOYSA-N
Mol Weight 320.39 g/mol
Molecular Formula C21H20O3
Exact Mass 320.141245 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BeCmzzmZuN7
Name 2,4-Dibenzoxy-6-methyl-phenol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 320.141244501 u
Formula C21H20O3
InChI InChI=1S/C21H20O3/c1-16-12-19(23-14-17-8-4-2-5-9-17)13-20(21(16)22)24-15-18-10-6-3-7-11-18/h2-13,22H,14-15H2,1H3
InChIKey WDJUSFQCCXXTIQ-UHFFFAOYSA-N
Molecular Weight 320.388 g/mol
SMILES C=1(C(=C(C)C=C(C1)OCC1=CC=CC=C1)O)OCC=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.923501