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9-(3,4-Dimethoxyphenyl)-1-[4-(methoxymethoxy)phenyl]-1-nonanone
SpectraBase Compound ID 6AU1NafcihG
InChI InChI=1S/C25H34O5/c1-27-19-30-22-15-13-21(14-16-22)23(26)11-9-7-5-4-6-8-10-20-12-17-24(28-2)25(18-20)29-3/h12-18H,4-11,19H2,1-3H3
InChIKey FMIUCKPDUZKSOI-UHFFFAOYSA-N
Mol Weight 414.5 g/mol
Molecular Formula C25H34O5
Exact Mass 414.240624 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5FOurW0VQSX
Name 9-(3,4-Dimethoxyphenyl)-1-[4-(methoxymethoxy)phenyl]-1-nonanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 414.240624190 u
Formula C25H34O5
InChI InChI=1S/C25H34O5/c1-27-19-30-22-15-13-21(14-16-22)23(26)11-9-7-5-4-6-8-10-20-12-17-24(28-2)25(18-20)29-3/h12-18H,4-11,19H2,1-3H3
InChIKey FMIUCKPDUZKSOI-UHFFFAOYSA-N
Molecular Weight 414.542 g/mol
SMILES C(CCCCCCCCC=1C=C(C(=CC1)OC)OC)(=O)C=1C=CC(=CC1)OCOC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.92582