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3,3'-(1-(4-Methoxyphenyl)ethane-1,2-diyl)bis(1-methyl-1H-indole-5-carbonitrile)
SpectraBase Compound ID 5vWUM2jO5wQ
InChI InChI=1S/C29H24N4O/c1-32-17-22(25-12-19(15-30)4-10-28(25)32)14-24(21-6-8-23(34-3)9-7-21)27-18-33(2)29-11-5-20(16-31)13-26(27)29/h4-13,17-18,24H,14H2,1-3H3
InChIKey PRWSYEVBAFPEPQ-UHFFFAOYSA-N
Mol Weight 444.54 g/mol
Molecular Formula C29H24N4O
Exact Mass 444.195011 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CT7DlOo5Sym
Name 3,3'-(1-(4-Methoxyphenyl)ethane-1,2-diyl)bis(1-methyl-1H-indole-5-carbonitrile)
Appearance Yellow liquid
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Formula C29H24N4O
InChI InChI=1S/C29H24N4O/c1-32-17-22(25-12-19(15-30)4-10-28(25)32)14-24(21-6-8-23(34-3)9-7-21)27-18-33(2)29-11-5-20(16-31)13-26(27)29/h4-13,17-18,24H,14H2,1-3H3
InChIKey PRWSYEVBAFPEPQ-UHFFFAOYSA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.1002/anie.202011657
Molecular Weight 444.538 g/mol
Reported Formula C29H24N4O
SMILES c1c(OC)ccc(C(Cc2c3cc(ccc3[n](c2)C)C#N)c2c[n](c3ccc(cc23)C#N)C)c1
SPLASH splash10-004i-0090000000-7640ae0fcce95ec64ae6
Source of Spectrum ACI-60-SM20-3all
Wiley ID 1880521