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5,5-Dimethyl-2-phenylacetylpyrazolidin-3-one
SpectraBase Compound ID 59kTUZbx3UH
InChI InChI=1S/C13H16N2O2/c1-13(2)9-12(17)15(14-13)11(16)8-10-6-4-3-5-7-10/h3-7,14H,8-9H2,1-2H3
InChIKey KXOLPCMDMUBEPJ-UHFFFAOYSA-N
Mol Weight 232.28 g/mol
Molecular Formula C13H16N2O2
Exact Mass 232.121178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2YPJQRmqRht
Name 5,5-Dimethyl-2-phenylacetylpyrazolidin-3-one
Alternate Name(s) 5,5-Dimethyl-2-(phenylacetyl)-3-pyrazolidinone
CAS Registry Number 53992-44-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N2O2
InChI InChI=1S/C13H16N2O2/c1-13(2)9-12(17)15(14-13)11(16)8-10-6-4-3-5-7-10/h3-7,14H,8-9H2,1-2H3
InChIKey KXOLPCMDMUBEPJ-UHFFFAOYSA-N
Molecular Weight 232.283 g/mol
SMILES N1C(CC(N1C(Cc1ccccc1)=O)=O)(C)C
SPLASH splash10-03dm-9400000000-54c419094080d5b2d2b0
Source of Spectrum J-40-913-0
Wiley ID 1233771