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4,5-Dimethyl-1-(2.2.2]trichloroethoxycarbonyl)pyrazolidin-3-one
SpectraBase Compound ID 1fgAL1QALSH
InChI InChI=1S/C8H11Cl3N2O3/c1-4-5(2)13(12-6(4)14)7(15)16-3-8(9,10)11/h4-5H,3H2,1-2H3,(H,12,14)
InChIKey NJAGYSPXNYQLMX-UHFFFAOYSA-N
Mol Weight 289.55 g/mol
Molecular Formula C8H11Cl3N2O3
Exact Mass 287.983525 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2suh3RYGBYX
Name 4,5-Dimethyl-1-(2.2.2]trichloroethoxycarbonyl)pyrazolidin-3-one
Alternate Name(s) 2,2,2-trichloroethyl 4,5-dimethyl-3-oxo-1-pyrazolidinecarboxylate
CAS Registry Number 130064-82-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H11Cl3N2O3
InChI InChI=1S/C8H11Cl3N2O3/c1-4-5(2)13(12-6(4)14)7(15)16-3-8(9,10)11/h4-5H,3H2,1-2H3,(H,12,14)
InChIKey NJAGYSPXNYQLMX-UHFFFAOYSA-N
Molecular Weight 289.546 g/mol
SMILES N1C(C(C(N1C(OCC(Cl)(Cl)Cl)=O)C)C)=O
SPLASH splash10-01ot-9820000000-5822537fc351ac11debf
Source of Spectrum J-55-6042-14
Wiley ID 1291161