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5,7-Diphenylethyl-5,7-dihydropyrido[2,3-b:6,5-b']diindole
SpectraBase Compound ID 4mapa2Lvmzp
InChI InChI=1S/C33H27N3/c1-3-11-24(12-4-1)19-21-35-30-17-9-7-15-26(30)28-23-29-27-16-8-10-18-31(27)36(33(29)34-32(28)35)22-20-25-13-5-2-6-14-25/h1-18,23H,19-22H2
InChIKey XWGROODDAZIXCK-UHFFFAOYSA-N
Mol Weight 465.6 g/mol
Molecular Formula C33H27N3
Exact Mass 465.220498 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9OSie7Jo01c
Name 5,7-Diphenylethyl-5,7-dihydropyrido[2,3-B:6,5-B']diindole
Comments Computed using HOSE algorithm
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Exact Mass 465.220497881 u
Formula C33H27N3
InChI InChI=1S/C33H27N3/c1-3-11-24(12-4-1)19-21-35-30-17-9-7-15-26(30)28-23-29-27-16-8-10-18-31(27)36(33(29)34-32(28)35)22-20-25-13-5-2-6-14-25/h1-18,23H,19-22H2
InChIKey XWGROODDAZIXCK-UHFFFAOYSA-N
Molecular Weight 465.600 g/mol
SMILES C12=C(C=C3C(=N2)N(C2=C3C=CC=C2)CCC2=CC=CC=C2)C2=C(N1CCC1=CC=CC=C1)C=CC=C2