| SpectraBase Compound ID | 1FW1eJkXoJk |
|---|---|
| InChI | InChI=1S/C14H22S/c1-2-3-4-5-6-7-13-8-10-14(12-15)11-9-13/h8-11,15H,2-7,12H2,1H3 |
| InChIKey | UCKUMYNFDOUCBV-UHFFFAOYSA-N |
| Mol Weight | 222.39 g/mol |
| Molecular Formula | C14H22S |
| Exact Mass | 222.144222 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6uunVbiKvk4 |
|---|---|
| Name | (4-Heptylphenyl)methanethiol |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H22S |
| InChI | InChI=1S/C14H22S/c1-2-3-4-5-6-7-13-8-10-14(12-15)11-9-13/h8-11,15H,2-7,12H2,1H3 |
| InChIKey | UCKUMYNFDOUCBV-UHFFFAOYSA-N |
| Molecular Weight | 222.390 g/mol |
| SMILES | SCc1ccc(cc1)CCCCCCC |
| SPLASH | splash10-000i-0910000000-c181b00d11fca982695d |
| Source of Spectrum | AH-135-197-2 |
| Wiley ID | 1576352 |