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1-Methyl-3-[(1-methylindole-3-yl)phenylmethyl]indole
SpectraBase Compound ID Ghvdn74Uqa8
InChI InChI=1S/C25H22N2/c1-26-16-21(19-12-6-8-14-23(19)26)25(18-10-4-3-5-11-18)22-17-27(2)24-15-9-7-13-20(22)24/h3-17,25H,1-2H3
InChIKey SDBNKZBCSQUVBL-UHFFFAOYSA-N
Mol Weight 350.47 g/mol
Molecular Formula C25H22N2
Exact Mass 350.178299 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H0KL2qzZJcG
Name 1-Methyl-3-[(1-methylindole-3-yl)phenylmethyl]indole
Comments Computed using HOSE algorithm
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Exact Mass 350.178298716 u
Formula C25H22N2
InChI InChI=1S/C25H22N2/c1-26-16-21(19-12-6-8-14-23(19)26)25(18-10-4-3-5-11-18)22-17-27(2)24-15-9-7-13-20(22)24/h3-17,25H,1-2H3
InChIKey SDBNKZBCSQUVBL-UHFFFAOYSA-N
Molecular Weight 350.465 g/mol
SMILES C1(=CN(C)C2=C1C=CC=C2)C(C1=CN(C)C2=C1C=CC=C2)C1=CC=CC=C1