| SpectraBase Compound ID | 7bJ7R1vXY53 |
|---|---|
| InChI | InChI=1S/C13H14ClNS/c1-16-10-12(4-2-3-9-15)11-5-7-13(14)8-6-11/h5-8,10H,2-4H2,1H3/b12-10+ |
| InChIKey | UAUKLIGODAMQFA-ZRDIBKRKSA-N |
| Mol Weight | 251.77 g/mol |
| Molecular Formula | C13H14ClNS |
| Exact Mass | 251.053548 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | E6h8uuETexe |
|---|---|
| Name | (5E)-5-(4-Chlorophenyl)-6-(methylthio)hex-5-enenitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H14ClNS |
| InChI | InChI=1S/C13H14ClNS/c1-16-10-12(4-2-3-9-15)11-5-7-13(14)8-6-11/h5-8,10H,2-4H2,1H3/b12-10+ |
| InChIKey | UAUKLIGODAMQFA-ZRDIBKRKSA-N |
| Molecular Weight | 251.775 g/mol |
| SMILES | C(#N)CCC\C(c1ccc(cc1)Cl)=C/SC |
| SPLASH | splash10-0udj-0890000000-7e17caed21b04ffeff2e |
| Source of Spectrum | F4-43-3458-6a |
| Wiley ID | 1690586 |