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Benzo[b]thiophene-3-acetonitrile, .alpha.-[(3-methylphenyl)methylene]-
SpectraBase Compound ID HkltevWBIS0
InChI InChI=1S/C18H13NS/c1-13-5-4-6-14(9-13)10-15(11-19)17-12-20-18-8-3-2-7-16(17)18/h2-10,12H,1H3/b15-10+
InChIKey WWCNYDBOHZSTAP-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 FjG0Z7HGVni
Name Benzo[b]thiophene-3-acetonitrile, .alpha.-[(3-methylphenyl)methylene]-
CAS Registry Number 89817-40-3
Comments Less than 3 mono-isotopic peaks
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Formula C18H13NS
InChI InChI=1S/C18H13NS/c1-13-5-4-6-14(9-13)10-15(11-19)17-12-20-18-8-3-2-7-16(17)18/h2-10,12H,1H3/b15-10+
InChIKey WWCNYDBOHZSTAP-XNTDXEJSSA-N
Molecular Weight 275.369 g/mol
SMILES c1(\C(=C\c2cc(C)ccc2)C#N)csc2c1cccc2
SPLASH splash10-03fr-0090000000-14ce8b74ed5a067539ba
Source of Spectrum Y-20-1457-0
Synonyms (2Z)-2-(1-benzothien-3-yl)-3-(3-methylphenyl)-2-propenenitrile 2-(3-Benzo[b]thienyl)-3-(m-tolyl)propenenitrile
Wiley ID 1279317