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N9-[4'-CHLORO-2'-BUTYNYL-1'-YL]-6-(4-METHOXYPHENYL)-PURINE
SpectraBase Compound ID FdIwgoOOz7c
InChI InChI=1S/C16H13ClN4O/c1-22-13-6-4-12(5-7-13)14-15-16(19-10-18-14)21(11-20-15)9-3-2-8-17/h4-7,10-11H,8-9H2,1H3
InChIKey UMNKXKCAWASYHL-UHFFFAOYSA-N
Mol Weight 312.76 g/mol
Molecular Formula C16H13ClN4O
Exact Mass 312.077789 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5z2Qt6Nstoi
Name N9-[4'-CHLORO-2'-BUTYNYL-1'-YL]-6-(4-METHOXYPHENYL)-PURINE
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H13ClN4O
InChI InChI=1S/C16H13ClN4O/c1-22-13-6-4-12(5-7-13)14-15-16(19-10-18-14)21(11-20-15)9-3-2-8-17/h4-7,10-11H,8-9H2,1H3
InChIKey UMNKXKCAWASYHL-UHFFFAOYSA-N
Literature Reference Author N.R.KODE,S.PHADTARE
Literature Reference Citation MOLECULES,16,5840(2011)
Literature Reference DOI 10.3390/molecules16075840
Molecular Weight 312.758 g/mol
Sample ID 433
Solvent DMSO-D6