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Dibenzyl-[2,9-dimethyl-9H-purin-6-yl]-amine

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Dibenzyl-[2,9-dimethyl-9H-purin-6-yl]-amine
SpectraBase Compound ID LcEERxfylEB
InChI InChI=1S/C21H21N5/c1-16-23-20-19(22-15-25(20)2)21(24-16)26(13-17-9-5-3-6-10-17)14-18-11-7-4-8-12-18/h3-12,15H,13-14H2,1-2H3
InChIKey AMPBZSXEUADANL-UHFFFAOYSA-N
Mol Weight 343.43 g/mol
Molecular Formula C21H21N5
Exact Mass 343.179696 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID APqqHNPqupX
Name Dibenzyl-[2,9-dimethyl-9H-purin-6-yl]-amine
Comments Computed using HOSE algorithm
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Exact Mass 343.179695696 u
Formula C21H21N5
InChI InChI=1S/C21H21N5/c1-16-23-20-19(22-15-25(20)2)21(24-16)26(13-17-9-5-3-6-10-17)14-18-11-7-4-8-12-18/h3-12,15H,13-14H2,1-2H3
InChIKey AMPBZSXEUADANL-UHFFFAOYSA-N
Molecular Weight 343.434 g/mol
SMILES C=12C(N(C)C=N2)=NC(=NC1N(CC=1C=CC=CC1)CC1=CC=CC=C1)C