| SpectraBase Compound ID | LIMVVM34rS1 |
|---|---|
| InChI | InChI=1S/C13H16O2S/c14-16(15,13-10-6-3-7-11-13)12-8-4-1-2-5-9-12/h3-4,6-8,10-12H,1-2,5,9H2 |
| InChIKey | LSVBZGFQBLUNRN-UHFFFAOYSA-N |
| Mol Weight | 236.33 g/mol |
| Molecular Formula | C13H16O2S |
| Exact Mass | 236.087101 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2Rk4FiLqaYf |
|---|---|
| Name | 3-(Phenylsulfonyl)cyclohept-1-ene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H16O2S |
| InChI | InChI=1S/C13H16O2S/c14-16(15,13-10-6-3-7-11-13)12-8-4-1-2-5-9-12/h3-4,6-8,10-12H,1-2,5,9H2 |
| InChIKey | LSVBZGFQBLUNRN-UHFFFAOYSA-N |
| Molecular Weight | 236.329 g/mol |
| SMILES | C1(S(=O)(=O)c2ccccc2)C=CCCCC1 |
| SPLASH | splash10-0005-9800000000-ffcae799c609cabc27a7 |
| Source of Spectrum | F4-40-1963-3k |
| Wiley ID | 1670749 |