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3,4-dichloro-N-[2-(5-methyl-1H-indol-3-yl)ethyl]benzamide
SpectraBase Compound ID 4r2lku66hLL
InChI InChI=1S/C18H16Cl2N2O/c1-11-2-5-17-14(8-11)13(10-22-17)6-7-21-18(23)12-3-4-15(19)16(20)9-12/h2-5,8-10,22H,6-7H2,1H3,(H,21,23)
InChIKey IDUQASRJFSFTHH-UHFFFAOYSA-N
Mol Weight 347.25 g/mol
Molecular Formula C18H16Cl2N2O
Exact Mass 346.063969 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BeZcVXRNFME
Name 3,4-Dichloro-N-[2-(5-methyl-1H-indol-3-yl)ethyl]benzamide
Comments Computed using HOSE algorithm
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Exact Mass 346.063968542 u
Formula C18H16Cl2N2O
InChI InChI=1S/C18H16Cl2N2O/c1-11-2-5-17-14(8-11)13(10-22-17)6-7-21-18(23)12-3-4-15(19)16(20)9-12/h2-5,8-10,22H,6-7H2,1H3,(H,21,23)
InChIKey IDUQASRJFSFTHH-UHFFFAOYSA-N
Molecular Weight 347.245 g/mol
SMILES N1C2=C(C(CCNC(C3=CC(Cl)=C(C=C3)Cl)=O)=C1)C=C(C=C2)C