| SpectraBase Compound ID | AtVQsoUfXGx |
|---|---|
| InChI | InChI=1S/C15H20S/c1-3-4-5-6-8-11-14(2)16-15-12-9-7-10-13-15/h3,7,9-10,12-13H,1-2,4-6,8,11H2 |
| InChIKey | XAPIVMQYMHXWFD-UHFFFAOYSA-N |
| Mol Weight | 232.38 g/mol |
| Molecular Formula | C15H20S |
| Exact Mass | 232.128572 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8GJH6ugmcke |
|---|---|
| Name | (1-Methyleneoct-7-enylthio)benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 232.128571818 u |
| Formula | C15H20S |
| InChI | InChI=1S/C15H20S/c1-3-4-5-6-8-11-14(2)16-15-12-9-7-10-13-15/h3,7,9-10,12-13H,1-2,4-6,8,11H2 |
| InChIKey | XAPIVMQYMHXWFD-UHFFFAOYSA-N |
| Molecular Weight | 232.385 g/mol |
| SMILES | C(SC=1C=CC=CC1)(=C)CCCCCC=C |