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6-(4,5-Dihydro-5-imino-4-phenyl-1,3,4-thiadiazol-2-yl)-2-hydroxy-4-phenylpyridine-3-carbonitrile
SpectraBase Compound ID Gml5NBSG3Rq
InChI InChI=1S/C20H13N5OS/c21-12-16-15(13-7-3-1-4-8-13)11-17(23-18(16)26)19-24-25(20(22)27-19)14-9-5-2-6-10-14/h1-11,22H,(H,23,26)
InChIKey ZKOUXLKLLDDNDQ-UHFFFAOYSA-N
Mol Weight 371.42 g/mol
Molecular Formula C20H13N5OS
Exact Mass 371.084081 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CXC0CzswqHy
Name 6-(4,5-Dihydro-5-imino-4-phenyl-1,3,4-thiadiazol-2-yl)-2-hydroxy-4-phenylpyridine-3-carbonitrile
Appearance Brown solid
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Formula C20H13N5OS
InChI InChI=1S/C20H13N5OS/c21-12-16-15(13-7-3-1-4-8-13)11-17(23-18(16)26)19-24-25(20(22)27-19)14-9-5-2-6-10-14/h1-11,22H,(H,23,26)
InChIKey ZKOUXLKLLDDNDQ-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP1000 EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3088
Molecular Weight 371.418 g/mol
SMILES Oc1c(c(cc(C2=NN(C(S2)=N)c2ccccc2)n1)-c1ccccc1)C#N
SPLASH splash10-014j-1190000000-158abc636f114bccaf05
Source of Spectrum Y-55-534-6a
Wiley ID 1879035