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Benzo[b]thiophene-3-acetonitrile, .alpha.-[(4-methylphenyl)methylene]-
SpectraBase Compound ID Iqdc7bPsuZF
InChI InChI=1S/C18H13NS/c1-13-6-8-14(9-7-13)10-15(11-19)17-12-20-18-5-3-2-4-16(17)18/h2-10,12H,1H3/b15-10+
InChIKey CEWBKCIJJYGCGO-XNTDXEJSSA-N
Mol Weight 275.37 g/mol
Molecular Formula C18H13NS
Exact Mass 275.076871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1lLSLssYyqK
Name Benzo[b]thiophene-3-acetonitrile, .alpha.-[(4-methylphenyl)methylene]-
CAS Registry Number 89817-39-0
Comments Less than 3 mono-isotopic peaks
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Formula C18H13NS
InChI InChI=1S/C18H13NS/c1-13-6-8-14(9-7-13)10-15(11-19)17-12-20-18-5-3-2-4-16(17)18/h2-10,12H,1H3/b15-10+
InChIKey CEWBKCIJJYGCGO-XNTDXEJSSA-N
Molecular Weight 275.369 g/mol
SMILES c1(\C(=C\c2ccc(cc2)C)C#N)csc2c1cccc2
SPLASH splash10-03fr-0090000000-20457b900de861a90f22
Source of Spectrum Y-20-1457-0
Synonyms (2Z)-2-(1-benzothien-3-yl)-3-(4-methylphenyl)-2-propenenitrile 2-(3-Benzo[b]thienyl)-3-(p-tolyl)propenenitrile
Wiley ID 1279316