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N9-(4'-CHLORO-2'-BUTYNYL-1'-YL)-2,6-DICHLORO-PURINE

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N9-(4'-CHLORO-2'-BUTYNYL-1'-YL)-2,6-DICHLORO-PURINE
SpectraBase Compound ID 8L9sNOZeBLL
InChI InChI=1S/C9H5Cl3N4/c10-3-1-2-4-16-5-13-6-7(11)14-9(12)15-8(6)16/h5H,3-4H2
InChIKey WEENHXPPRPRELZ-UHFFFAOYSA-N
Mol Weight 275.53 g/mol
Molecular Formula C9H5Cl3N4
Exact Mass 273.957979 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KDD7aR2AJf6
Name N9-(4'-CHLORO-2'-BUTYNYL-1'-YL)-2,6-DICHLORO-PURINE
Compound Number 10A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H5Cl3N4
InChI InChI=1S/C9H5Cl3N4/c10-3-1-2-4-16-5-13-6-7(11)14-9(12)15-8(6)16/h5H,3-4H2
InChIKey WEENHXPPRPRELZ-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 275.524 g/mol
Sample ID 421
Solvent DMSO-D6