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N-[3,5-bis(trifluoromethyl)phenyl]-5-ethyl-2-thiophenecarboxamide

View entire compound with spectra: 2 NMR

N-[3,5-bis(trifluoromethyl)phenyl]-5-ethyl-2-thiophenecarboxamide
SpectraBase Compound ID BDuNzbju0Ix
InChI InChI=1S/C15H11F6NOS/c1-2-11-3-4-12(24-11)13(23)22-10-6-8(14(16,17)18)5-9(7-10)15(19,20)21/h3-7H,2H2,1H3,(H,22,23)
InChIKey GXMGVXAGFGHTJF-UHFFFAOYSA-N
Mol Weight 367.31 g/mol
Molecular Formula C15H11F6NOS
Exact Mass 367.046554 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CxxVUFkT7mc
Name N-[3,5-bis(Trifluoromethyl)phenyl]-5-ethyl-2-thiophenecarboxamide
Comments Computed using HOSE algorithm
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Exact Mass 367.046554129 u
Formula C15H11F6NOS
InChI InChI=1S/C15H11F6NOS/c1-2-11-3-4-12(24-11)13(23)22-10-6-8(14(16,17)18)5-9(7-10)15(19,20)21/h3-7H,2H2,1H3,(H,22,23)
InChIKey GXMGVXAGFGHTJF-UHFFFAOYSA-N
Molecular Weight 367.309 g/mol
SMILES N(C(C=1SC(CC)=CC1)=O)C1=CC(C(F)(F)F)=CC(C(F)(F)F)=C1