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2-Benzoyl-4,4,5-trimethyl-2-pyrazolin-3-one
SpectraBase Compound ID LStt0LQw1dC
InChI InChI=1S/C13H14N2O2/c1-9-13(2,3)12(17)15(14-9)11(16)10-7-5-4-6-8-10/h4-8H,1-3H3
InChIKey JJOMHAUWVDUBBL-UHFFFAOYSA-N
Mol Weight 230.27 g/mol
Molecular Formula C13H14N2O2
Exact Mass 230.105528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 64Iy3RuMjJm
Name 2-Benzoyl-4,4,5-trimethyl-2-pyrazolin-3-one
Alternate Name(s) 2-Benzoyl-4,4,5-trimethyl-3-pyrazolone 2-Benzoyl-4,4,5-trimethyl-pyrazol-3-one 4,4,5-trimethyl-2-(phenylcarbonyl)pyrazol-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N2O2
InChI InChI=1S/C13H14N2O2/c1-9-13(2,3)12(17)15(14-9)11(16)10-7-5-4-6-8-10/h4-8H,1-3H3
InChIKey JJOMHAUWVDUBBL-UHFFFAOYSA-N
Molecular Weight 230.267 g/mol
SMILES C1(=NN(C(C1(C)C)=O)C(=O)c1ccccc1)C
SPLASH splash10-0a4i-0910000000-fdd997d1d77ffe617adf
Source of Spectrum Y-28-49-2
Wiley ID 1231844