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2-bromo-N-[2-(5-methyl-1H-indol-3-yl)ethyl]benzamide
SpectraBase Compound ID 7KjyvwYJRJj
InChI InChI=1S/C18H17BrN2O/c1-12-6-7-17-15(10-12)13(11-21-17)8-9-20-18(22)14-4-2-3-5-16(14)19/h2-7,10-11,21H,8-9H2,1H3,(H,20,22)
InChIKey HNNPIQPIZAWZAM-UHFFFAOYSA-N
Mol Weight 357.25 g/mol
Molecular Formula C18H17BrN2O
Exact Mass 356.052426 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 90kLDXoBEBR
Name 2-Bromo-N-[2-(5-methyl-1H-indol-3-yl)ethyl]benzamide
Comments Computed using HOSE algorithm
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Exact Mass 356.052426174 u
Formula C18H17BrN2O
InChI InChI=1S/C18H17BrN2O/c1-12-6-7-17-15(10-12)13(11-21-17)8-9-20-18(22)14-4-2-3-5-16(14)19/h2-7,10-11,21H,8-9H2,1H3,(H,20,22)
InChIKey HNNPIQPIZAWZAM-UHFFFAOYSA-N
Molecular Weight 357.251 g/mol
SMILES N(C(C1=C(Br)C=CC=C1)=O)CCC1=CNC2=C1C=C(C=C2)C