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1-N-{[2'-(trifluoroacetyl)-1'-methyl-1'-ethenyl]amino}-2-benzoylbenzene
SpectraBase Compound ID EMVr8DFBlEB
InChI InChI=1S/C18H14F3NO2/c1-12(11-16(23)18(19,20)21)22-15-10-6-5-9-14(15)17(24)13-7-3-2-4-8-13/h2-11,22H,1H3/b12-11-
InChIKey YEPQXZLTDVXGQL-QXMHVHEDSA-N
Mol Weight 333.31 g/mol
Molecular Formula C18H14F3NO2
Exact Mass 333.097663 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C2cC73YOi21
Name 1-N-{[2'-(Trifluoroacetyl)-1'-methyl-1'-ethenyl]amino}-2-benzoylbenzene
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 333.097663182 u
Formula C18H14F3NO2
InChI InChI=1S/C18H14F3NO2/c1-12(11-16(23)18(19,20)21)22-15-10-6-5-9-14(15)17(24)13-7-3-2-4-8-13/h2-11,22H,1H3/b12-11-
InChIKey YEPQXZLTDVXGQL-QXMHVHEDSA-N
Molecular Weight 333.310 g/mol
SMILES C(C(\C=C\(NC=1C(C(=O)C2=CC=CC=C2)=CC=CC1)C)=O)(F)(F)F