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3-(3,4-Dimethoxyphenyl)-1-(2-hydroxy-4,6-dimethoxyphenyl)propan-1-one
SpectraBase Compound ID GBTTfAeQvS2
InChI InChI=1S/C19H22O6/c1-22-13-10-15(21)19(18(11-13)25-4)14(20)7-5-12-6-8-16(23-2)17(9-12)24-3/h6,8-11,21H,5,7H2,1-4H3
InChIKey MQEOTHTYNCMSAN-UHFFFAOYSA-N
Mol Weight 346.38 g/mol
Molecular Formula C19H22O6
Exact Mass 346.141638 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID G0LOtilWJce
Name 3-(3,4-Dimethoxyphenyl)-1-(2-hydroxy-4,6-dimethoxyphenyl)propan-1-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 346.141638422 u
Formula C19H22O6
InChI InChI=1S/C19H22O6/c1-22-13-10-15(21)19(18(11-13)25-4)14(20)7-5-12-6-8-16(23-2)17(9-12)24-3/h6,8-11,21H,5,7H2,1-4H3
InChIKey MQEOTHTYNCMSAN-UHFFFAOYSA-N
Molecular Weight 346.379 g/mol
SMILES C1(=C(C=C(C=C1OC)OC)O)C(=O)CCC1=CC(=C(C=C1)OC)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.959438