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4-(Benzo[b]thiophen-2-yl)benzonitrile
SpectraBase Compound ID 5qxRm3mYNrT
InChI InChI=1S/C15H9NS/c16-10-11-5-7-12(8-6-11)15-9-13-3-1-2-4-14(13)17-15/h1-9H
InChIKey GDRMBPBBGSQSTN-UHFFFAOYSA-N
Mol Weight 235.3 g/mol
Molecular Formula C15H9NS
Exact Mass 235.04557 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6JSFzFOZp04
Name 4-(Benzo[b]thiophen-2-yl)benzonitrile
Alternate Name(s) 4-(1-benzothiophen-2-yl)benzonitrile 4-(1-benzothiophen-2-yl)benzenecarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H9NS
InChI InChI=1S/C15H9NS/c16-10-11-5-7-12(8-6-11)15-9-13-3-1-2-4-14(13)17-15/h1-9H
InChIKey GDRMBPBBGSQSTN-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo201081v
Molecular Weight 235.304 g/mol
SMILES c1cc2cc(sc2cc1)-c1ccc(cc1)C#N
SPLASH splash10-000i-0190000000-0d6ff501b67e2cbd0815
Source of Spectrum J-76-7548-2i
Wiley ID 1746806