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3,3-Dichloro-1-(4-fluorophenyl)-4-(2,2,2-trifluoroethyl)pyrrolidin-2-one
SpectraBase Compound ID 29OK5SCFuda
InChI InChI=1S/C12H9Cl2F4NO/c13-12(14)7(5-11(16,17)18)6-19(10(12)20)9-3-1-8(15)2-4-9/h1-4,7H,5-6H2
InChIKey IXJKPCIWRRRDIZ-UHFFFAOYSA-N
Mol Weight 330.11 g/mol
Molecular Formula C12H9Cl2F4NO
Exact Mass 328.999732 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GhqYggeUCLL
Name 3,3-Dichloro-1-(4-fluorophenyl)-4-(2,2,2-trifluoroethyl)pyrrolidin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9Cl2F4NO
InChI InChI=1S/C12H9Cl2F4NO/c13-12(14)7(5-11(16,17)18)6-19(10(12)20)9-3-1-8(15)2-4-9/h1-4,7H,5-6H2
InChIKey IXJKPCIWRRRDIZ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cjoc.201900075
Molecular Weight 330.110 g/mol
SMILES c1cc(ccc1F)N1C(C(C(C1)CC(F)(F)F)(Cl)Cl)=O
SPLASH splash10-009j-3903000000-b8c14551f9b974f71586
Source of Spectrum CJC-37-SM19-3b
Wiley ID 1819484