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1-[4-[2-(6-Amino-9H-purin-8-ylsulfanyl)ethoxy]phenyl]ethanone
SpectraBase Compound ID EO9RjsHnInT
InChI InChI=1S/C15H15N5O2S/c1-9(21)10-2-4-11(5-3-10)22-6-7-23-15-19-12-13(16)17-8-18-14(12)20-15/h2-5,8H,6-7H2,1H3,(H3,16,17,18,19,20)
InChIKey RQMJJWLDLORNSY-UHFFFAOYSA-N
Mol Weight 329.38 g/mol
Molecular Formula C15H15N5O2S
Exact Mass 329.094646 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eyswb43sqXF
Name 1-[4-[2-(6-Amino-9H-purin-8-ylsulfanyl)ethoxy]phenyl]ethanone
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Formula C15H15N5O2S
InChI InChI=1S/C15H15N5O2S/c1-9(21)10-2-4-11(5-3-10)22-6-7-23-15-19-12-13(16)17-8-18-14(12)20-15/h2-5,8H,6-7H2,1H3,(H3,16,17,18,19,20)
InChIKey RQMJJWLDLORNSY-UHFFFAOYSA-N
Molecular Weight 329.378 g/mol
SMILES [nH]1c(nc2c(ncnc12)N)SCCOc1ccc(C(=O)C)cc1
SPLASH splash10-014i-1900000000-1424eb05fe5a992c09cf
Synonyms 1-[4-[2-[(6-amino-7H-purin-8-yl)sulfanyl]ethoxy]phenyl]ethanone 1-[4-[2-[(6-amino-7H-purin-8-yl)thio]ethoxy]phenyl]ethanone 1-[4-[2-[(6-azanyl-7H-purin-8-yl)sulfanyl]ethoxy]phenyl]ethanone
Wiley ID 1464175