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4-(4-Methylphenyl)-4-oxo-2-(1-piperidinyl)butanoic acid
SpectraBase Compound ID AHDR34T9UHL
InChI InChI=1S/C16H21NO3/c1-12-5-7-13(8-6-12)15(18)11-14(16(19)20)17-9-3-2-4-10-17/h5-8,14H,2-4,9-11H2,1H3,(H,19,20)
InChIKey MLCJITZNFWSJTO-UHFFFAOYSA-N
Mol Weight 275.35 g/mol
Molecular Formula C16H21NO3
Exact Mass 275.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HN51Nf3jMSL
Name 4-(4-Methylphenyl)-4-oxo-2-(1-piperidinyl)butanoic acid
Alternate Name(s) 4-(4-Methylphenyl)-4-oxidanylidene-2-piperidin-1-yl-butanoic acid 4-(4-Methylphenyl)-4-oxo-2-piperidin-1-ylbutanoic acid 4-keto-2-piperidino-4-(p-tolyl)butyric acid 4-Oxo-2-(1-piperidyl)-4-(p-tolyl)butanoic acid Butanoic acid, 4-oxo-2-(1-piperidyl)-4-(4-tolyl)-
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Formula C16H21NO3
InChI InChI=1S/C16H21NO3/c1-12-5-7-13(8-6-12)15(18)11-14(16(19)20)17-9-3-2-4-10-17/h5-8,14H,2-4,9-11H2,1H3,(H,19,20)
InChIKey MLCJITZNFWSJTO-UHFFFAOYSA-N
Molecular Weight 275.348 g/mol
SMILES OC(C(CC(c1ccc(cc1)C)=O)N1CCCCC1)=O
SPLASH splash10-0159-9500000000-8d7b3a1fc120809ae6eb
Wiley ID 1444305