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1-Pyrazolidinecarboxylic acid, 5,5-dimethyl-3-oxo-, phenylmethyl ester
SpectraBase Compound ID Jcyfdmecl1u
InChI InChI=1S/C13H16N2O3/c1-13(2)8-11(16)14-15(13)12(17)18-9-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3,(H,14,16)
InChIKey DXLFYPXVTGKXGA-UHFFFAOYSA-N
Mol Weight 248.28 g/mol
Molecular Formula C13H16N2O3
Exact Mass 248.116092 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E2DjpHyEqES
Name 1-Pyrazolidinecarboxylic acid, 5,5-dimethyl-3-oxo-, phenylmethyl ester
Alternate Name(s) 1-(benzyloxycarbonyl)-5,5-dimethylpyrazolidin-3-one benzyl 5,5-dimethyl-3-oxo-1-pyrazolidinecarboxylate
CAS Registry Number 130064-88-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N2O3
InChI InChI=1S/C13H16N2O3/c1-13(2)8-11(16)14-15(13)12(17)18-9-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3,(H,14,16)
InChIKey DXLFYPXVTGKXGA-UHFFFAOYSA-N
Molecular Weight 248.282 g/mol
SMILES N1C(CC(N1C(OCc1ccccc1)=O)(C)C)=O
SPLASH splash10-03du-2920000000-d8199d4c3b5c3ce99cbe
Source of Spectrum J-55-6042-19
Wiley ID 1250951