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2-(6-naphtho[1,2-b][1]benzothiolyl)propanenitrile
SpectraBase Compound ID G4KGlFLIxsO
InChI InChI=1S/C19H13NS/c1-12(11-20)16-10-13-6-2-3-7-14(13)19-18(16)15-8-4-5-9-17(15)21-19/h2-10,12H,1H3
InChIKey VDNUJIJWSMJGAG-UHFFFAOYSA-N
Mol Weight 287.38 g/mol
Molecular Formula C19H13NS
Exact Mass 287.076871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1658pqJ6pfu
Name 2-(6-naphtho[1,2-b][1]benzothiolyl)propanenitrile
CAS Registry Number 89817-35-6
Comments Less than 3 mono-isotopic peaks
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Formula C19H13NS
InChI InChI=1S/C19H13NS/c1-12(11-20)16-10-13-6-2-3-7-14(13)19-18(16)15-8-4-5-9-17(15)21-19/h2-10,12H,1H3
InChIKey VDNUJIJWSMJGAG-UHFFFAOYSA-N
Molecular Weight 287.380 g/mol
SMILES c12c(c(C(C#N)C)cc3c2cccc3)c2ccccc2s1
SPLASH splash10-000i-0090000000-c45adfec30caf31384f4
Source of Spectrum Y-20-1457-0
Synonyms 2-naphtho[1,2-b]benzothiophen-6-ylpropanenitrile 2-naphtho[1,2-b]benzothiophen-6-ylpropionitrile 2-naphtho[1,2-b][1]benzothiol-6-ylpropanenitrile
Wiley ID 1291015