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2,4-bis[2'-(4'-Methylphenyl-2'-oxoethylidene]cyclobutane-1,3-dione
SpectraBase Compound ID 1SicCgMrBok
InChI InChI=1S/C22H16O4/c1-13-3-7-15(8-4-13)19(23)11-17-21(25)18(22(17)26)12-20(24)16-9-5-14(2)6-10-16/h3-12H,1-2H3/b17-11-,18-12+
InChIKey RZJQJMCANPHSLJ-MJZABRMRSA-N
Mol Weight 344.37 g/mol
Molecular Formula C22H16O4
Exact Mass 344.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3n2EEwfCni3
Name 2,4-bis[2'-(4'-Methylphenyl-2'-oxoethylidene]cyclobutane-1,3-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H16O4
InChI InChI=1S/C22H16O4/c1-13-3-7-15(8-4-13)19(23)11-17-21(25)18(22(17)26)12-20(24)16-9-5-14(2)6-10-16/h3-12H,1-2H3/b17-11-,18-12+
InChIKey RZJQJMCANPHSLJ-MJZABRMRSA-N
Molecular Weight 344.366 g/mol
SMILES C1(\C(C(\C1=C\C(c1ccc(cc1)C)=O)=O)=C/C(c1ccc(cc1)C)=O)=O
SPLASH splash10-014l-0839000000-fbae6c12f40f14b28def
Source of Spectrum H-91-1468-6a
Wiley ID 1693414