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Phenylmethyl 1-(1-phenyl-1H-indol-3-yl)-3,4-dihydroisoquinoline-2(1H)-carboxylate
SpectraBase Compound ID BKUhuBJvzql
InChI InChI=1S/C31H26N2O2/c34-31(35-22-23-11-3-1-4-12-23)32-20-19-24-13-7-8-16-26(24)30(32)28-21-33(25-14-5-2-6-15-25)29-18-10-9-17-27(28)29/h1-18,21,30H,19-20,22H2
InChIKey DNMCVGWAEIIAGZ-UHFFFAOYSA-N
Mol Weight 458.56 g/mol
Molecular Formula C31H26N2O2
Exact Mass 458.199428 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 62Sx0OwoGwW
Name Phenylmethyl 1-(1-phenyl-1H-indol-3-yl)-3,4-dihydroisoquinoline-2(1H)-carboxylate
Appearance Off colorless solid
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Formula C31H26N2O2
InChI InChI=1S/C31H26N2O2/c34-31(35-22-23-11-3-1-4-12-23)32-20-19-24-13-7-8-16-26(24)30(32)28-21-33(25-14-5-2-6-15-25)29-18-10-9-17-27(28)29/h1-18,21,30H,19-20,22H2
InChIKey DNMCVGWAEIIAGZ-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI positive ion
Literature Reference DOI 10.3762/bjoc.10.226
Molecular Weight 458.561 g/mol
Reported Formula C31H26N2O2
SMILES c1cc2c(cc1)C(N(CC2)C(OCc1ccccc1)=O)c1c[n](c2c1cccc2)-c1ccccc1
SPLASH splash10-00dl-5309000000-033a206b269a82056d42
Source of Spectrum BJO-10-SM11-7g
Thin-Layer Chromatography Rf = 0.43 (PE/EtOAc, 5:1)
Wiley ID 1854013