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N-[2-(5-chloro-1H-indol-3-yl)ethyl]-4-fluorobenzamide

View entire compound with spectra: 2 NMR

N-[2-(5-chloro-1H-indol-3-yl)ethyl]-4-fluorobenzamide
SpectraBase Compound ID K6wPe6oRnO8
InChI InChI=1S/C17H14ClFN2O/c18-13-3-6-16-15(9-13)12(10-21-16)7-8-20-17(22)11-1-4-14(19)5-2-11/h1-6,9-10,21H,7-8H2,(H,20,22)
InChIKey XDRXQFQRSKWBFR-UHFFFAOYSA-N
Mol Weight 316.76 g/mol
Molecular Formula C17H14ClFN2O
Exact Mass 316.077869 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 824JjdrMYE8
Name N-[2-(5-Chloro-1H-indol-3-yl)ethyl]-4-fluorobenzamide
Comments Computed using HOSE algorithm
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Exact Mass 316.077868941 u
Formula C17H14ClFN2O
InChI InChI=1S/C17H14ClFN2O/c18-13-3-6-16-15(9-13)12(10-21-16)7-8-20-17(22)11-1-4-14(19)5-2-11/h1-6,9-10,21H,7-8H2,(H,20,22)
InChIKey XDRXQFQRSKWBFR-UHFFFAOYSA-N
Molecular Weight 316.763 g/mol
SMILES N(C(C=1C=CC(=CC1)F)=O)CCC1=CNC2=C1C=C(C=C2)Cl