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2-[(8-Phenyl-9H-purin-6-yl)thio]-5-(pyridin-4-yl)-1,3,4-oxadiazole
SpectraBase Compound ID IhKtmOYXK14
InChI InChI=1S/C18H11N7OS/c1-2-4-11(5-3-1)14-22-13-15(23-14)20-10-21-17(13)27-18-25-24-16(26-18)12-6-8-19-9-7-12/h1-10H,(H,20,21,22,23)
InChIKey QNUDWJKYUHRDEW-UHFFFAOYSA-N
Mol Weight 373.39 g/mol
Molecular Formula C18H11N7OS
Exact Mass 373.074579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FWiRYnxO9ee
Name 2-[(8-Phenyl-9H-purin-6-yl)thio]-5-(pyridin-4-yl)-1,3,4-oxadiazole
Appearance White solid
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Formula C18H11N7OS
InChI InChI=1S/C18H11N7OS/c1-2-4-11(5-3-1)14-22-13-15(23-14)20-10-21-17(13)27-18-25-24-16(26-18)12-6-8-19-9-7-12/h1-10H,(H,20,21,22,23)
InChIKey QNUDWJKYUHRDEW-UHFFFAOYSA-N
Instrument Name Thermofinnigan MAT95XL
Ionization Type EI
Molecular Weight 373.394 g/mol
SMILES [nH]1c2c(nc1-c1ccccc1)c(ncn2)Sc1oc(nn1)-c1ccncc1
SPLASH splash10-014i-2190000000-314b479237bb465bc036
Source of Spectrum WO2014079545A1
Wiley ID 1850015