| SpectraBase Compound ID | 3n1OaoFLRHD |
|---|---|
| InChI | InChI=1S/C14H20OS/c1-2-3-9-14(12-15)16-11-10-13-7-5-4-6-8-13/h4-8,12,14H,2-3,9-11H2,1H3 |
| InChIKey | NVRHVVRRELKAOX-UHFFFAOYSA-N |
| Mol Weight | 236.37 g/mol |
| Molecular Formula | C14H20OS |
| Exact Mass | 236.123486 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6cO2HPyDXu8 |
|---|---|
| Name | 2-(Phenethylthio)hexanal |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H20OS |
| InChI | InChI=1S/C14H20OS/c1-2-3-9-14(12-15)16-11-10-13-7-5-4-6-8-13/h4-8,12,14H,2-3,9-11H2,1H3 |
| InChIKey | NVRHVVRRELKAOX-UHFFFAOYSA-N |
| Molecular Weight | 236.373 g/mol |
| SMILES | C(=O)C(SCCc1ccccc1)CCCC |
| SPLASH | splash10-0pb9-1920000000-c2ca9f453924a6eb5efa |
| Source of Spectrum | J-59-7382-15 |
| Synonyms | 2-[(2-Phenylethyl)sulfanyl]hexanal |
| Wiley ID | 1238309 |