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1-(2,2,2-Trichloroethoxycarbonyl)-5-methylpyrazolidin-3-one
SpectraBase Compound ID 6ZefOtwLFZT
InChI InChI=1S/C7H9Cl3N2O3/c1-4-2-5(13)11-12(4)6(14)15-3-7(8,9)10/h4H,2-3H2,1H3,(H,11,13)
InChIKey SCCAEJFZNLEIPC-UHFFFAOYSA-N
Mol Weight 275.52 g/mol
Molecular Formula C7H9Cl3N2O3
Exact Mass 273.967875 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JQDdYzXbKD0
Name 1-(2,2,2-Trichloroethoxycarbonyl)-5-methylpyrazolidin-3-one
Alternate Name(s) 2,2,2-trichloroethyl 5-methyl-3-oxo-1-pyrazolidinecarboxylate 2-Acetyl-cis-indazolidin-3-one
CAS Registry Number 56700-60-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H9Cl3N2O3
InChI InChI=1S/C7H9Cl3N2O3/c1-4-2-5(13)11-12(4)6(14)15-3-7(8,9)10/h4H,2-3H2,1H3,(H,11,13)
InChIKey SCCAEJFZNLEIPC-UHFFFAOYSA-N
Molecular Weight 275.519 g/mol
SMILES N1C(CC(N1C(OCC(Cl)(Cl)Cl)=O)C)=O
SPLASH splash10-0006-9100000000-bcddc838932837cf6e01
Source of Spectrum J-40-3509-0
Wiley ID 1277526