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9-Benzyl-8-iodo-9H-purine

View entire compound with spectra: 1 MS (GC)

9-Benzyl-8-iodo-9H-purine
SpectraBase Compound ID IoMPJDbi5nC
InChI InChI=1S/C12H9IN4/c13-12-16-10-6-14-8-15-11(10)17(12)7-9-4-2-1-3-5-9/h1-6,8H,7H2
InChIKey BPAHWHJCLRUJOT-UHFFFAOYSA-N
Mol Weight 336.14 g/mol
Molecular Formula C12H9IN4
Exact Mass 335.987191 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2v3As8TOeO
Name 9-Benzyl-8-iodo-9H-purine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9IN4
InChI InChI=1S/C12H9IN4/c13-12-16-10-6-14-8-15-11(10)17(12)7-9-4-2-1-3-5-9/h1-6,8H,7H2
InChIKey BPAHWHJCLRUJOT-UHFFFAOYSA-N
Molecular Weight 336.136 g/mol
SMILES c1([n](c2c(n1)cncn2)Cc1ccccc1)I
SPLASH splash10-0a4u-7094000000-01f21a6fcf7cc58bc79d
Source of Spectrum F4-45-3033-3b
Synonyms 8-Iodo-9-(phenylmethyl)purine 9-Benzyl-8-iodopurine 8-Iodanyl-9-(phenylmethyl)purine
Wiley ID 1741871