| SpectraBase Compound ID | 3jVV4fpgGF8 |
|---|---|
| InChI | InChI=1S/C14H20OS/c1-2-3-4-6-11-14(12-15)16-13-9-7-5-8-10-13/h5,7-10,12,14H,2-4,6,11H2,1H3 |
| InChIKey | HZDYXYWDUJXKRE-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 | F0eS96fq564 |
|---|---|
| Name | Phenylthiooctanal |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H20OS |
| InChI | InChI=1S/C14H20OS/c1-2-3-4-6-11-14(12-15)16-13-9-7-5-8-10-13/h5,7-10,12,14H,2-4,6,11H2,1H3 |
| InChIKey | HZDYXYWDUJXKRE-UHFFFAOYSA-N |
| Molecular Weight | 236.373 g/mol |
| SMILES | c1(SC(C=O)CCCCCC)ccccc1 |
| SPLASH | splash10-0a4i-0290000000-ec2c660b69737a251dfe |
| Source of Spectrum | F-49-2019-2 |
| Wiley ID | 1238311 |