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1-(4-Trifluoromethylphenyl)-5-methylpyrrolidin-2-one
SpectraBase Compound ID 3WVetN4dJ03
InChI InChI=1S/C12H12F3NO/c1-8-2-7-11(17)16(8)10-5-3-9(4-6-10)12(13,14)15/h3-6,8H,2,7H2,1H3
InChIKey FMYGREWNASSFGJ-UHFFFAOYSA-N
Mol Weight 243.23 g/mol
Molecular Formula C12H12F3NO
Exact Mass 243.087098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KPWYaeXARg7
Name 1-(4-Trifluoromethylphenyl)-5-methylpyrrolidin-2-one
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 243.087098498 u
Formula C12H12F3NO
InChI InChI=1S/C12H12F3NO/c1-8-2-7-11(17)16(8)10-5-3-9(4-6-10)12(13,14)15/h3-6,8H,2,7H2,1H3
InChIKey FMYGREWNASSFGJ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/anie.201509465
Molecular Weight 243.229 g/mol
Quality 94
SMILES C=1(C(F)(F)F)C=CC(N2C(C)CCC2=O)=CC1
SPLASH splash10-004l-0490000000-9b5d831f0e0e27364391
Source of Spectrum ACI-55-SM7-3l (DOI: 10.1002/anie.201509465)
Wiley ID 1895258