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2-Chloranyl-6-phenyl-9-(phenylmethyl)purine
SpectraBase Compound ID 9PVoIsYXilL
InChI InChI=1S/C18H13ClN4/c19-18-21-15(14-9-5-2-6-10-14)16-17(22-18)23(12-20-16)11-13-7-3-1-4-8-13/h1-10,12H,11H2
InChIKey CUWBCCIAROCSQI-UHFFFAOYSA-N
Mol Weight 320.78 g/mol
Molecular Formula C18H13ClN4
Exact Mass 320.082874 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6axPrJZrElh
Name 2-Chloranyl-6-phenyl-9-(phenylmethyl)purine
Alternate Name(s) 2-Chloro-6-phenyl-9-(phenylmethyl)purine 9-Benzyl-2-chloro-6-phenyl-purine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13ClN4
InChI InChI=1S/C18H13ClN4/c19-18-21-15(14-9-5-2-6-10-14)16-17(22-18)23(12-20-16)11-13-7-3-1-4-8-13/h1-10,12H,11H2
InChIKey CUWBCCIAROCSQI-UHFFFAOYSA-N
Molecular Weight 320.783 g/mol
SMILES c12c([n](Cc3ccccc3)cn1)nc(nc2-c1ccccc1)Cl
SPLASH splash10-00r6-7019000000-7f3c9e48776995aebbe6
Source of Spectrum F-52-5633-3
Wiley ID 796282