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N-[2-(1H-Indol-3-yl)ethyl]-N-(4-methoxybenzyl)amine, 1ac derivative
SpectraBase Compound ID FXBPqfn2KGq
InChI InChI=1S/C20H22N2O2/c1-15(23)22(14-16-7-9-18(24-2)10-8-16)12-11-17-13-21-20-6-4-3-5-19(17)20/h3-10,13,21H,11-12,14H2,1-2H3
InChIKey FTQSTMJNCRJXQZ-UHFFFAOYSA-N
Mol Weight 322.41 g/mol
Molecular Formula C20H22N2O2
Exact Mass 322.168128 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2YMJ7oc801V
Name N-[2-(1H-Indol-3-yl)ethyl]-N-(4-methoxybenzyl)amine, 1ac derivative
Comments Computed using HOSE algorithm
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Exact Mass 322.168127954 u
Formula C20H22N2O2
InChI InChI=1S/C20H22N2O2/c1-15(23)22(14-16-7-9-18(24-2)10-8-16)12-11-17-13-21-20-6-4-3-5-19(17)20/h3-10,13,21H,11-12,14H2,1-2H3
InChIKey FTQSTMJNCRJXQZ-UHFFFAOYSA-N
Molecular Weight 322.408 g/mol
SMILES C(C)(=O)N(CC1=CC=C(C=C1)OC)CCC1=CNC2=C1C=CC=C2