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9H-Purine, 6-[[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]thio]-
SpectraBase Compound ID 9HXVrgISQgo
InChI InChI=1S/C14H10N6OS/c1-2-4-9(5-3-1)13-20-19-10(21-13)6-22-14-11-12(16-7-15-11)17-8-18-14/h1-5,7-8H,6H2,(H,15,16,17,18)
InChIKey NGEQEDNZXDITCL-UHFFFAOYSA-N
Mol Weight 310.34 g/mol
Molecular Formula C14H10N6OS
Exact Mass 310.06368 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8mfImTB8Rx8
Name 9H-Purine, 6-[[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]thio]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H10N6OS
InChI InChI=1S/C14H10N6OS/c1-2-4-9(5-3-1)13-20-19-10(21-13)6-22-14-11-12(16-7-15-11)17-8-18-14/h1-5,7-8H,6H2,(H,15,16,17,18)
InChIKey NGEQEDNZXDITCL-UHFFFAOYSA-N
Molecular Weight 310.335 g/mol
SMILES [nH]1cnc2c1ncnc2SCc1nnc(o1)-c1ccccc1
SPLASH splash10-03di-3913000000-71703a76836c053ae9f6
Source of Spectrum IY-1-4339-7
Synonyms 2-Phenyl-5-(7H-purin-6-ylsulfanylmethyl)-1,3,4-oxadiazole
Wiley ID 1651380