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4-(4-Methylbenzoyl)-2,6-piperazinedione
SpectraBase Compound ID BUxFlGbfGSQ
InChI InChI=1S/C12H12N2O3/c1-8-2-4-9(5-3-8)12(17)14-6-10(15)13-11(16)7-14/h2-5H,6-7H2,1H3,(H,13,15,16)
InChIKey MPGIBRLEIRRDRY-UHFFFAOYSA-N
Mol Weight 232.24 g/mol
Molecular Formula C12H12N2O3
Exact Mass 232.084792 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzNcYVhGpMG
Name 4-(4-Methylbenzoyl)-2,6-piperazinedione
Alternate Name(s) 4-(4-Methylbenzoyl)piperazine-2,6-dione 4-(4-Methylphenyl)carbonylpiperazine-2,6-dione 4-p-toluoylpiperazine-2,6-quinone 4-[(4-methylphenyl)-oxomethyl]piperazine-2,6-dione Piperazine-2,5-dione, 4-(4-methylbenzoyl)-
CAS Registry Number 259228-04-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12N2O3
InChI InChI=1S/C12H12N2O3/c1-8-2-4-9(5-3-8)12(17)14-6-10(15)13-11(16)7-14/h2-5H,6-7H2,1H3,(H,13,15,16)
InChIKey MPGIBRLEIRRDRY-UHFFFAOYSA-N
Molecular Weight 232.239 g/mol
SMILES N1C(CN(CC1=O)C(=O)c1ccc(cc1)C)=O
SPLASH splash10-014i-6900000000-5d6e98d3d61f39fe7d50
Source of Spectrum AD-0-2532-0
Wiley ID 1428496