| SpectraBase Compound ID | CViah0vx3Bj |
|---|---|
| InChI | InChI=1S/C14H18S/c1-2-5-9-13(8-4-1)12-15-14-10-6-3-7-11-14/h3,6-8,10-11H,1-2,4-5,9,12H2 |
| InChIKey | QJPFTYGJQUZUSC-UHFFFAOYSA-N |
| Mol Weight | 218.36 g/mol |
| Molecular Formula | C14H18S |
| Exact Mass | 218.112922 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 33c6G0ljU0 |
|---|---|
| Name | 1-(Phenylsulfanylmethyl)cycloheptene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H18S |
| InChI | InChI=1S/C14H18S/c1-2-5-9-13(8-4-1)12-15-14-10-6-3-7-11-14/h3,6-8,10-11H,1-2,4-5,9,12H2 |
| InChIKey | QJPFTYGJQUZUSC-UHFFFAOYSA-N |
| Molecular Weight | 218.358 g/mol |
| SMILES | C1(=CCCCCC1)CSc1ccccc1 |
| SPLASH | splash10-0a4i-2900000000-5c92efc54c274e160964 |
| Source of Spectrum | KC-1992-2613-9 |
| Wiley ID | 776983 |