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3,3-Dichloro-1-(4-methoxyphenyl)-4-(2,2,2-trifluoroethyl)pyrrolidin-2-one
SpectraBase Compound ID 9C7s35QRY6k
InChI InChI=1S/C13H12Cl2F3NO2/c1-21-10-4-2-9(3-5-10)19-7-8(6-12(16,17)18)13(14,15)11(19)20/h2-5,8H,6-7H2,1H3
InChIKey NEZQADIYOFHXAY-UHFFFAOYSA-N
Mol Weight 342.15 g/mol
Molecular Formula C13H12Cl2F3NO2
Exact Mass 341.019719 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FrFPB9aAHb9
Name 3,3-Dichloro-1-(4-methoxyphenyl)-4-(2,2,2-trifluoroethyl)pyrrolidin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12Cl2F3NO2
InChI InChI=1S/C13H12Cl2F3NO2/c1-21-10-4-2-9(3-5-10)19-7-8(6-12(16,17)18)13(14,15)11(19)20/h2-5,8H,6-7H2,1H3
InChIKey NEZQADIYOFHXAY-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cjoc.201900075
Molecular Weight 342.145 g/mol
SMILES c1cc(ccc1OC)N1C(C(C(C1)CC(F)(F)F)(Cl)Cl)=O
SPLASH splash10-0006-1619000000-adf3c4fb3dbcbb84844e
Source of Spectrum CJC-37-SM20-3c
Wiley ID 1819485