| SpectraBase Compound ID | BSumeNGiQS9 |
|---|---|
| InChI | InChI=1S/C11H13FS2/c1-11(13-7-2-8-14-11)9-3-5-10(12)6-4-9/h3-6H,2,7-8H2,1H3 |
| InChIKey | KCPNFGGYERCZED-UHFFFAOYSA-N |
| Mol Weight | 228.34 g/mol |
| Molecular Formula | C11H13FS2 |
| Exact Mass | 228.044271 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KoZ9yCsDt0r |
|---|---|
| Name | 2-(4-fluorophenyl)-2-methyl-1,3-dithiane |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H13FS2 |
| InChI | InChI=1S/C11H13FS2/c1-11(13-7-2-8-14-11)9-3-5-10(12)6-4-9/h3-6H,2,7-8H2,1H3 |
| InChIKey | KCPNFGGYERCZED-UHFFFAOYSA-N |
| Molecular Weight | 228.343 g/mol |
| SMILES | C1(SCCCS1)(c1ccc(cc1)F)C |
| SPLASH | splash10-0ug0-0930000000-5fe2f15b1a6eb430b0c2 |
| Source of Spectrum | SK-31-1593-8 |
| Wiley ID | 881997 |