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N-{4-[(diethylamino)sulfonyl]phenyl}-2,2,2-trifluoroacetamide
SpectraBase Compound ID FwYpTj0FPyz
InChI InChI=1S/C12H15F3N2O3S/c1-3-17(4-2)21(19,20)10-7-5-9(6-8-10)16-11(18)12(13,14)15/h5-8H,3-4H2,1-2H3,(H,16,18)
InChIKey UTRLGWRULBAZCC-UHFFFAOYSA-N
Mol Weight 324.32 g/mol
Molecular Formula C12H15F3N2O3S
Exact Mass 324.075548 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fnf63CXL3yU
Name N-{4-[(Diethylamino)sulfonyl]phenyl}-2,2,2-trifluoroacetamide
Comments Computed using HOSE algorithm
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Exact Mass 324.075548011 u
Formula C12H15F3N2O3S
InChI InChI=1S/C12H15F3N2O3S/c1-3-17(4-2)21(19,20)10-7-5-9(6-8-10)16-11(18)12(13,14)15/h5-8H,3-4H2,1-2H3,(H,16,18)
InChIKey UTRLGWRULBAZCC-UHFFFAOYSA-N
Molecular Weight 324.318 g/mol
SMILES N(C1=CC=C(C=C1)S(=O)(N(CC)CC)=O)C(C(F)(F)F)=O