| SpectraBase Compound ID | Ip13AVQBgWQ |
|---|---|
| InChI | InChI=1S/C6H5F3S/c1-4-2-3-5(10-4)6(7,8)9/h2-3H,1H3 |
| InChIKey | RSNNHKFOJCLWBX-UHFFFAOYSA-N |
| Mol Weight | 166.16 g/mol |
| Molecular Formula | C6H5F3S |
| Exact Mass | 166.006406 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7hjysoQ8SGU |
|---|---|
| Name | 2-Methyl-5-(trifluoromethyl)thiophene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H5F3S |
| InChI | InChI=1S/C6H5F3S/c1-4-2-3-5(10-4)6(7,8)9/h2-3H,1H3 |
| InChIKey | RSNNHKFOJCLWBX-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1021/ol501967c |
| Molecular Weight | 166.161 g/mol |
| SMILES | c1(ccc(s1)C(F)(F)F)C |
| SPLASH | splash10-014k-8900000000-44979c606558607edc88 |
| Source of Spectrum | A1-16-4268/SMS23-arb15 |
| Wiley ID | 1751163 |