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2-amino-3-(1H-indol-3-yl)-N-propylpropanamide
SpectraBase Compound ID 46opqyOvUNn
InChI InChI=1S/C14H19N3O/c1-2-7-16-14(18)12(15)8-10-9-17-13-6-4-3-5-11(10)13/h3-6,9,12,17H,2,7-8,15H2,1H3,(H,16,18)
InChIKey CVCDKHDTHVZZKC-UHFFFAOYSA-N
Mol Weight 245.33 g/mol
Molecular Formula C14H19N3O
Exact Mass 245.152812 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2tQZrR11qc6
Name 2-Amino-3-(1H-indol-3-yl)-N-propylpropanamide
Comments Computed using HOSE algorithm
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Exact Mass 245.152812243 u
Formula C14H19N3O
InChI InChI=1S/C14H19N3O/c1-2-7-16-14(18)12(15)8-10-9-17-13-6-4-3-5-11(10)13/h3-6,9,12,17H,2,7-8,15H2,1H3,(H,16,18)
InChIKey CVCDKHDTHVZZKC-UHFFFAOYSA-N
SMILES N1C2=C(C(CC(C(=O)NCCC)N)=C1)C=CC=C2