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3-Ethoxy-4-(4-phenoxyphenyl)cyclobutene-1,2-dione

View entire compound with spectra: 1 FTIR

3-Ethoxy-4-(4-phenoxyphenyl)cyclobutene-1,2-dione
SpectraBase Compound ID 7Um8jfcVDAK
InChI InChI=1S/C18H14O4/c1-2-21-18-15(16(19)17(18)20)12-8-10-14(11-9-12)22-13-6-4-3-5-7-13/h3-11H,2H2,1H3
InChIKey PWBZFCMWPAUTMF-UHFFFAOYSA-N
Mol Weight 294.31 g/mol
Molecular Formula C18H14O4
Exact Mass 294.089209 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Cdo9X9kf8Np
Name 3-Ethoxy-4-(4-phenoxyphenyl)cyclobutene-1,2-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 294.089208927 u
Formula C18H14O4
InChI InChI=1S/C18H14O4/c1-2-21-18-15(16(19)17(18)20)12-8-10-14(11-9-12)22-13-6-4-3-5-7-13/h3-11H,2H2,1H3
InChIKey PWBZFCMWPAUTMF-UHFFFAOYSA-N
Molecular Weight 294.306 g/mol
SMILES C1(OC2=CC=CC=C2)=CC=C(C=C1)C=1C(C(C1OCC)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.823305