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1-Propanone, 1-(2-benzofuranyl)-3-[[3-(trifluoromethyl)phenyl]amino]-
SpectraBase Compound ID BpbYorOW6cu
InChI InChI=1S/C18H14F3NO2/c19-18(20,21)13-5-3-6-14(11-13)22-9-8-15(23)17-10-12-4-1-2-7-16(12)24-17/h1-7,10-11,22H,8-9H2
InChIKey BSBUMMBOBHSXQA-UHFFFAOYSA-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 8YLNgqSNc2I
Name 1-Propanone, 1-(2-benzofuranyl)-3-[[3-(trifluoromethyl)phenyl]amino]-
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/c19-18(20,21)13-5-3-6-14(11-13)22-9-8-15(23)17-10-12-4-1-2-7-16(12)24-17/h1-7,10-11,22H,8-9H2
InChIKey BSBUMMBOBHSXQA-UHFFFAOYSA-N
Molecular Weight 333.310 g/mol
SMILES C12=CC=CC=C2C=C(O1)C(=O)CCNC1=CC(=CC=C1)C(F)(F)F