![4-{[(4-Methoxyphenyl)thio]ethynyl}benzonitrile](/api/spectrum/7KuD6khPVvD/structure.png?h=300&w=458 "4-{[(4-Methoxyphenyl)thio]ethynyl}benzonitrile")
| SpectraBase Compound ID | IbhebygvVJw |
|---|---|
| InChI | InChI=1S/C16H11NOS/c1-18-15-6-8-16(9-7-15)19-11-10-13-2-4-14(12-17)5-3-13/h2-9H,1H3 |
| InChIKey | MPXPOIIYLYFMGP-UHFFFAOYSA-N |
| Mol Weight | 265.33 g/mol |
| Molecular Formula | C16H11NOS |
| Exact Mass | 265.056135 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7KuD6khPVvD |
|---|---|
| Name | 4-{[(4-Methoxyphenyl)thio]ethynyl}benzonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H11NOS |
| InChI | InChI=1S/C16H11NOS/c1-18-15-6-8-16(9-7-15)19-11-10-13-2-4-14(12-17)5-3-13/h2-9H,1H3 |
| InChIKey | MPXPOIIYLYFMGP-UHFFFAOYSA-N |
| Molecular Weight | 265.330 g/mol |
| SMILES | C(#Cc1ccc(C#N)cc1)Sc1ccc(cc1)OC |
| SPLASH | splash10-014i-0090000000-84876ab66dae1678f695 |
| Source of Spectrum | F4-43-3458-1g |
| Wiley ID | 1690588 |