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Butanedial, bis[(3-hydroxy-4-methoxyphenyl)methylene]-
SpectraBase Compound ID AbpzkG1SABk
InChI InChI=1S/C20H18O6/c1-25-19-5-3-13(9-17(19)23)7-15(11-21)16(12-22)8-14-4-6-20(26-2)18(24)10-14/h3-12,23-24H,1-2H3/b15-7+,16-8+
InChIKey WLBCKVSJWVGRHW-BGPOSVGRSA-N
Mol Weight 354.36 g/mol
Molecular Formula C20H18O6
Exact Mass 354.110338 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1QCAr9UF6s7
Name Butanedial, bis[(3-hydroxy-4-methoxyphenyl)methylene]-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 354.110338294 u
Formula C20H18O6
InChI InChI=1S/C20H18O6/c1-25-19-5-3-13(9-17(19)23)7-15(11-21)16(12-22)8-14-4-6-20(26-2)18(24)10-14/h3-12,23-24H,1-2H3/b15-7+,16-8+
InChIKey WLBCKVSJWVGRHW-BGPOSVGRSA-N
Molecular Weight 354.358 g/mol
SMILES C1(\C=C\(\C(=C\C2=CC(O)=C(C=C2)OC)C=O)C=O)=CC(O)=C(C=C1)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.86298