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2-Acetyl-4,5-dimethyl-1-(2,2,2-trichloroethoxycarbonyl)-pyrazolidin-3-one
SpectraBase Compound ID 3EhfW8SI1p1
InChI InChI=1S/C10H13Cl3N2O4/c1-5-6(2)14(15(7(3)16)8(5)17)9(18)19-4-10(11,12)13/h5-6H,4H2,1-3H3
InChIKey ZDYIFRQNYRVZCX-UHFFFAOYSA-N
Mol Weight 331.58 g/mol
Molecular Formula C10H13Cl3N2O4
Exact Mass 329.99409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JsyBxgdRCdu
Name 2-Acetyl-4,5-dimethyl-1-(2,2,2-trichloroethoxycarbonyl)-pyrazolidin-3-one
CAS Registry Number 130064-84-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H13Cl3N2O4
InChI InChI=1S/C10H13Cl3N2O4/c1-5-6(2)14(15(7(3)16)8(5)17)9(18)19-4-10(11,12)13/h5-6H,4H2,1-3H3
InChIKey ZDYIFRQNYRVZCX-UHFFFAOYSA-N
Molecular Weight 331.583 g/mol
SMILES C1(N(N(C(C1C)=O)C(=O)C)C(OCC(Cl)(Cl)Cl)=O)C
SPLASH splash10-01qi-6691000000-33b7ae2ee2cecbd7382d
Source of Spectrum J-55-6042-15
Synonyms 2,2,2-trichloroethyl 2-acetyl-4,5-dimethyl-3-oxo-1-pyrazolidinecarboxylate
Wiley ID 1327384