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4-[(4-Methoxyphenyl)sulfinyl]benzonitrile

View entire compound with spectra: 2 MS (GC)

4-[(4-Methoxyphenyl)sulfinyl]benzonitrile
SpectraBase Compound ID L07PByjmxQ6
InChI InChI=1S/C14H11NO2S/c1-17-12-4-8-14(9-5-12)18(16)13-6-2-11(10-15)3-7-13/h2-9H,1H3
InChIKey VKFACFGXIWNFGV-UHFFFAOYSA-N
Mol Weight 257.31 g/mol
Molecular Formula C14H11NO2S
Exact Mass 257.05105 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LPsAbPKuAO8
Name 4-[(4-Methoxyphenyl)sulfinyl]benzonitrile
Alternate Name(s) 4-(4-Methoxybenzenesulfinyl)benzonitrile 4-((4-Methoxyphenyl)sulfinyl)benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H11NO2S
InChI InChI=1S/C14H11NO2S/c1-17-12-4-8-14(9-5-12)18(16)13-6-2-11(10-15)3-7-13/h2-9H,1H3
InChIKey VKFACFGXIWNFGV-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol801431z
Molecular Weight 257.307 g/mol
SMILES c1cc(ccc1C#N)S(=O)c1ccc(cc1)OC
SPLASH splash10-0zfr-0940000000-84ea317e7a84c79d9ef9
Source of Spectrum A1-10-3891/SM7-1f
Wiley ID 1759717