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2,6,8-trichloro-7-(2-phenyloxyethyl)purine
SpectraBase Compound ID 2khe6Gxjy5U
InChI InChI=1S/C13H9Cl3N4O/c14-10-9-11(18-12(15)17-10)19-13(16)20(9)6-7-21-8-4-2-1-3-5-8/h1-5H,6-7H2
InChIKey KGPAQMPBFDLWGA-UHFFFAOYSA-N
Mol Weight 343.6 g/mol
Molecular Formula C13H9Cl3N4O
Exact Mass 341.984194 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JkCiwcxjqfU
Name 2,6,8-trichloro-7-(2-phenyloxyethyl)purine
Alternate Name(s) 2,6,8-trichloro-7-(2-phenoxyethyl)-7H-purine phenyl 2-(2,6,8-trichloro-7H-purin-7-yl)ethyl ether 2,6,8-tris(chloranyl)-7-(2-phenoxyethyl)purine
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Formula C13H9Cl3N4O
InChI InChI=1S/C13H9Cl3N4O/c14-10-9-11(18-12(15)17-10)19-13(16)20(9)6-7-21-8-4-2-1-3-5-8/h1-5H,6-7H2
InChIKey KGPAQMPBFDLWGA-UHFFFAOYSA-N
Molecular Weight 343.601 g/mol
SMILES c12nc([n](c2c(Cl)nc(n1)Cl)CCOc1ccccc1)Cl
SPLASH splash10-0006-6529000000-f08046c2bfc171016ae6
Source of Spectrum HC-20-926-0
Wiley ID 1336216