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1-(3,4-Dimethoxyphenyl)-5-methoxyundecan-3-one

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

1-(3,4-Dimethoxyphenyl)-5-methoxyundecan-3-one
SpectraBase Compound ID 6GC2vR65Wla
InChI InChI=1S/C20H32O4/c1-5-6-7-8-9-18(22-2)15-17(21)12-10-16-11-13-19(23-3)20(14-16)24-4/h11,13-14,18H,5-10,12,15H2,1-4H3
InChIKey SRZBRSAHWMIRDY-UHFFFAOYSA-N
Mol Weight 336.5 g/mol
Molecular Formula C20H32O4
Exact Mass 336.23006 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JJL847Q3KLf
Name 1-(3,4-Dimethoxyphenyl)-5-methoxyundecan-3-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 336.230059506 u
Formula C20H32O4
InChI InChI=1S/C20H32O4/c1-5-6-7-8-9-18(22-2)15-17(21)12-10-16-11-13-19(23-3)20(14-16)24-4/h11,13-14,18H,5-10,12,15H2,1-4H3
InChIKey SRZBRSAHWMIRDY-UHFFFAOYSA-N
Molecular Weight 336.472 g/mol
SMILES C(CC(CC(CCCCCC)OC)=O)C1=CC(=C(C=C1)OC)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.811346