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9-Benzyl-6-chloro-2-iodo-9H-purine
SpectraBase Compound ID 9hf0WexWAgL
InChI InChI=1S/C12H8ClIN4/c13-10-9-11(17-12(14)16-10)18(7-15-9)6-8-4-2-1-3-5-8/h1-5,7H,6H2
InChIKey AHKGTSBDRDNGCM-UHFFFAOYSA-N
Mol Weight 370.58 g/mol
Molecular Formula C12H8ClIN4
Exact Mass 369.948219 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Z4n1HavESb
Name 9-Benzyl-6-chloro-2-iodo-9H-purine
Alternate Name(s) 6-Chloranyl-2-iodanyl-9-(phenylmethyl)purine 6-Chloro-2-iodo-9-(phenylmethyl)purine 9-Benzyl-6-chloro-2-iodo-purine
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Formula C12H8ClIN4
InChI InChI=1S/C12H8ClIN4/c13-10-9-11(17-12(14)16-10)18(7-15-9)6-8-4-2-1-3-5-8/h1-5,7H,6H2
InChIKey AHKGTSBDRDNGCM-UHFFFAOYSA-N
Molecular Weight 370.581 g/mol
SMILES c12c(nc[n]2Cc2ccccc2)c(Cl)nc(n1)I
SPLASH splash10-006x-9136000000-5e979f127591a685401c
Source of Spectrum F-52-5634-7
Wiley ID 796275