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1,2-Bis(4-isopropylphenyl)ethane-1,2-dione

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

1,2-Bis(4-isopropylphenyl)ethane-1,2-dione
SpectraBase Compound ID 1d9dlOaLQ6A
InChI InChI=1S/C20H22O2/c1-13(2)15-5-9-17(10-6-15)19(21)20(22)18-11-7-16(8-12-18)14(3)4/h5-14H,1-4H3
InChIKey LVSZQGATCLRLCP-UHFFFAOYSA-N
Mol Weight 294.39 g/mol
Molecular Formula C20H22O2
Exact Mass 294.16198 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2S45oZO69nl
Name 1,2-bis(4-Isopropylphenyl)ethane-1,2-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 294.161979946 u
Formula C20H22O2
InChI InChI=1S/C20H22O2/c1-13(2)15-5-9-17(10-6-15)19(21)20(22)18-11-7-16(8-12-18)14(3)4/h5-14H,1-4H3
InChIKey LVSZQGATCLRLCP-UHFFFAOYSA-N
SMILES C=1C=C(C(C(C2=CC=C(C=C2)C(C)C)=O)=O)C=CC1C(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.923862