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1H-Pyrazole-1-acetic acid, 3,5-dimethyl-.alpha.-(2-oxo-2-phenylethyl)-
SpectraBase Compound ID 3DUiRCqmuV
InChI InChI=1S/C15H16N2O3/c1-10-8-11(2)17(16-10)13(15(19)20)9-14(18)12-6-4-3-5-7-12/h3-8,13H,9H2,1-2H3,(H,19,20)
InChIKey JWCXDRLQQIFFKJ-UHFFFAOYSA-N
Mol Weight 272.3 g/mol
Molecular Formula C15H16N2O3
Exact Mass 272.116092 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jo68GzkwgMH
Name 1H-Pyrazole-1-acetic acid, 3,5-dimethyl-.alpha.-(2-oxo-2-phenylethyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16N2O3
InChI InChI=1S/C15H16N2O3/c1-10-8-11(2)17(16-10)13(15(19)20)9-14(18)12-6-4-3-5-7-12/h3-8,13H,9H2,1-2H3,(H,19,20)
InChIKey JWCXDRLQQIFFKJ-UHFFFAOYSA-N
Molecular Weight 272.304 g/mol
SMILES OC(C([n]1nc(C)cc1C)CC(=O)c1ccccc1)=O
SPLASH splash10-00di-6900000000-78bc3fd3d2b50c9ddf87
Source of Spectrum IY-2-4804-7
Synonyms 2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxo-4-phenylbutanoic acid 2-(3,5-dimethyl-1-pyrazolyl)-4-oxo-4-phenylbutanoic acid 2-(3,5-dimethylpyrazol-1-yl)-4-oxo-4-phenylbutanoic acid 2-(3,5-dimethylpyrazol-1-yl)-4-oxo-4-phenyl-butanoic acid 2-(3,5-dimethylpyrazol-1-yl)-4-oxidanylidene-4-phenyl-butanoic acid
Wiley ID 1656030