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N-(4-chloro-2-fluorophenyl)-3,4-dimethylbenzamide
SpectraBase Compound ID JIwpyviAcU6
InChI InChI=1S/C15H13ClFNO/c1-9-3-4-11(7-10(9)2)15(19)18-14-6-5-12(16)8-13(14)17/h3-8H,1-2H3,(H,18,19)
InChIKey XMLGVNJPLLTKBV-UHFFFAOYSA-N
Mol Weight 277.73 g/mol
Molecular Formula C15H13ClFNO
Exact Mass 277.06697 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DZGySagV8Cq
Name N-(4-Chloro-2-fluorophenyl)-3,4-dimethylbenzamide
Comments Computed using HOSE algorithm
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Exact Mass 277.066969905 u
Formula C15H13ClFNO
InChI InChI=1S/C15H13ClFNO/c1-9-3-4-11(7-10(9)2)15(19)18-14-6-5-12(16)8-13(14)17/h3-8H,1-2H3,(H,18,19)
InChIKey XMLGVNJPLLTKBV-UHFFFAOYSA-N
Molecular Weight 277.726 g/mol
SMILES N(C=1C(=CC(Cl)=CC1)F)C(C=1C=C(C)C(=CC1)C)=O