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1,1-Dimethylethyl 1-(1-phenyl-1H-indol-3-yl)-3,4-dihydroisoquinoline-2(1H)-carboxylate
SpectraBase Compound ID lmpQWBvtWv
InChI InChI=1S/C28H28N2O2/c1-28(2,3)32-27(31)29-18-17-20-11-7-8-14-22(20)26(29)24-19-30(21-12-5-4-6-13-21)25-16-10-9-15-23(24)25/h4-16,19,26H,17-18H2,1-3H3
InChIKey ZODLWFQCNFVVEL-UHFFFAOYSA-N
Mol Weight 424.54 g/mol
Molecular Formula C28H28N2O2
Exact Mass 424.215078 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HYysmU8nrVD
Name 1,1-Dimethylethyl 1-(1-phenyl-1H-indol-3-yl)-3,4-dihydroisoquinoline-2(1H)-carboxylate
Appearance Colorless solid
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Formula C28H28N2O2
InChI InChI=1S/C28H28N2O2/c1-28(2,3)32-27(31)29-18-17-20-11-7-8-14-22(20)26(29)24-19-30(21-12-5-4-6-13-21)25-16-10-9-15-23(24)25/h4-16,19,26H,17-18H2,1-3H3
InChIKey ZODLWFQCNFVVEL-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI positive ion
Literature Reference DOI 10.3762/bjoc.10.226
Molecular Weight 424.544 g/mol
Reported Formula C28H28N2O2
SMILES c1cc2c(cc1)C(N(CC2)C(OC(C)(C)C)=O)c1c[n](c2c1cccc2)-c1ccccc1
SPLASH splash10-00di-0759000000-75ce49b30b0e06af3d0a
Source of Spectrum BJO-10-SM9-7a
Thin-Layer Chromatography Rf = 0.57 (PE/EtOAc, 5:1)
Wiley ID 1854008