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2-(5-benzyl-3,6-diketo-piperazin-2-yl)acetic acid
SpectraBase Compound ID 7TrVZkwRNe8
InChI InChI=1S/C13H14N2O4/c16-11(17)7-10-13(19)14-9(12(18)15-10)6-8-4-2-1-3-5-8/h1-5,9-10H,6-7H2,(H,14,19)(H,15,18)(H,16,17)
InChIKey VNHJXYUDIBQDDX-UHFFFAOYSA-N
Mol Weight 262.26 g/mol
Molecular Formula C13H14N2O4
Exact Mass 262.095357 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C1nJpiwilGZ
Name 2-(5-benzyl-3,6-diketo-piperazin-2-yl)acetic acid
Alternate Name(s) 2-(5-benzyl-3,6-dioxo-piperazin-2-yl)acetic acid 2-[3,6-bis(oxidanylidene)-5-(phenylmethyl)piperazin-2-yl]ethanoic acid 2-[3,6-dioxo-5-(phenylmethyl)-2-piperazinyl]acetic acid
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Formula C13H14N2O4
InChI InChI=1S/C13H14N2O4/c16-11(17)7-10-13(19)14-9(12(18)15-10)6-8-4-2-1-3-5-8/h1-5,9-10H,6-7H2,(H,14,19)(H,15,18)(H,16,17)
InChIKey VNHJXYUDIBQDDX-UHFFFAOYSA-N
Molecular Weight 262.265 g/mol
SMILES N1C(C(CC(=O)O)NC(C1Cc1ccccc1)=O)=O
SPLASH splash10-0006-9210000000-e59261b68a59ff86409b
Wiley ID 1473658