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(E)-1-(3,4-Dimethoxyphenyl)dodec-4-en-3-one

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

(E)-1-(3,4-Dimethoxyphenyl)dodec-4-en-3-one
SpectraBase Compound ID EBP9HfvoqFS
InChI InChI=1S/C20H30O3/c1-4-5-6-7-8-9-10-11-18(21)14-12-17-13-15-19(22-2)20(16-17)23-3/h10-11,13,15-16H,4-9,12,14H2,1-3H3/b11-10+
InChIKey ZNOLGYFCFIVHQI-ZHACJKMWSA-N
Mol Weight 318.46 g/mol
Molecular Formula C20H30O3
Exact Mass 318.219495 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9NrQlb7egot
Name (E)-1-(3,4-Dimethoxyphenyl)dodec-4-en-3-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 318.219494823 u
Formula C20H30O3
InChI InChI=1S/C20H30O3/c1-4-5-6-7-8-9-10-11-18(21)14-12-17-13-15-19(22-2)20(16-17)23-3/h10-11,13,15-16H,4-9,12,14H2,1-3H3/b11-10+
InChIKey ZNOLGYFCFIVHQI-ZHACJKMWSA-N
Molecular Weight 318.457 g/mol
SMILES C(CC(\C=C\CCCCCCC)=O)C1=CC(=C(C=C1)OC)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.984115