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1H-Indole-3-acetamide, 1-[(4-chlorophenyl)methyl]-N-(4-fluorophenyl)-.alpha.-oxo-
SpectraBase Compound ID 8fxeBToFXRV
InChI InChI=1S/C23H16ClFN2O2/c24-16-7-5-15(6-8-16)13-27-14-20(19-3-1-2-4-21(19)27)22(28)23(29)26-18-11-9-17(25)10-12-18/h1-12,14H,13H2,(H,26,29)
InChIKey GQEUYLIIOUXLMV-UHFFFAOYSA-N
Mol Weight 406.84 g/mol
Molecular Formula C23H16ClFN2O2
Exact Mass 406.088434 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CvyFlfGr8mO
Name 1H-Indole-3-acetamide, 1-[(4-chlorophenyl)methyl]-N-(4-fluorophenyl)-.alpha.-oxo-
Comments Computed using HOSE algorithm
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Exact Mass 406.088433624 u
Formula C23H16ClFN2O2
InChI InChI=1S/C23H16ClFN2O2/c24-16-7-5-15(6-8-16)13-27-14-20(19-3-1-2-4-21(19)27)22(28)23(29)26-18-11-9-17(25)10-12-18/h1-12,14H,13H2,(H,26,29)
InChIKey GQEUYLIIOUXLMV-UHFFFAOYSA-N
Molecular Weight 406.844 g/mol
SMILES C=1C2=C(C=CC1)C(=CN2CC=1C=CC(=CC1)Cl)C(C(NC1=CC=C(C=C1)F)=O)=O