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[1,2,5]Oxadiazolo[3,4-c]pyridine-6-carbonitrile, 4,5-dihydro-4,7-diphenyl-
SpectraBase Compound ID CFNiuTP0Neo
InChI InChI=1S/C18H12N4O/c19-11-14-15(12-7-3-1-4-8-12)17-18(22-23-21-17)16(20-14)13-9-5-2-6-10-13/h1-10,16,20H
InChIKey VVDODGJWLHCSHZ-UHFFFAOYSA-N
Mol Weight 300.32 g/mol
Molecular Formula C18H12N4O
Exact Mass 300.101111 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2N26zjU9bc
Name [1,2,5]Oxadiazolo[3,4-c]pyridine-6-carbonitrile, 4,5-dihydro-4,7-diphenyl-
CAS Registry Number 85731-36-8
Comments Less than 3 mono-isotopic peaks
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Formula C18H12N4O
InChI InChI=1S/C18H12N4O/c19-11-14-15(12-7-3-1-4-8-12)17-18(22-23-21-17)16(20-14)13-9-5-2-6-10-13/h1-10,16,20H
InChIKey VVDODGJWLHCSHZ-UHFFFAOYSA-N
Molecular Weight 300.321 g/mol
SMILES N1C(c2c(C(=C1C#N)c1ccccc1)non2)c1ccccc1
SPLASH splash10-0udi-0009000000-c33c21a9472ef4cfaede
Source of Spectrum Y-19-1487-0
Synonyms 4,7-diphenyl-4,5-dihydro[1,2,5]oxadiazolo[3,4-c]pyridine-6-carbonitrile 6-Cyano-4,5-dihydro-4,7-diphenyl[1,2,5]oxadiazolo[3,4-c]pyridine
Wiley ID 1302997