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1-[4-(2-Pyrimidyl)-1-piperazinyl]-1,3-butandione
SpectraBase Compound ID HkKz12FSokY
InChI InChI=1S/C12H16N4O2/c1-10(17)9-11(18)15-5-7-16(8-6-15)12-13-3-2-4-14-12/h2-4H,5-9H2,1H3
InChIKey PMWSNEJBNSBQFL-UHFFFAOYSA-N
Mol Weight 248.29 g/mol
Molecular Formula C12H16N4O2
Exact Mass 248.127326 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F7zPZ5hK7pP
Name 1-[4-(2-Pyrimidyl)-1-piperazinyl]-1,3-butandione
Alternate Name(s) 1-(4-(pyrimidin-2-yl)piperazin-1-yl)butane-1,3-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16N4O2
InChI InChI=1S/C12H16N4O2/c1-10(17)9-11(18)15-5-7-16(8-6-15)12-13-3-2-4-14-12/h2-4H,5-9H2,1H3
InChIKey PMWSNEJBNSBQFL-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.19953280218
Molecular Weight 248.286 g/mol
SMILES C(CC(C)=O)(=O)N1CCN(CC1)c1ncccn1
SPLASH splash10-05gi-3910000000-92153312fb3111a19bb5
Source of Spectrum APC-328-190-5
Wiley ID 1799194