| SpectraBase Compound ID | bx1Gjs9v9k |
|---|---|
| InChI | InChI=1S/C10H5F3OS/c11-10(12,13)8-3-1-2-7-6(8)4-5-15-9(7)14/h1-5H |
| InChIKey | VAGSVSGGZLTFBN-UHFFFAOYSA-N |
| Mol Weight | 230.2 g/mol |
| Molecular Formula | C10H5F3OS |
| Exact Mass | 230.00132 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7VwKblB4sHn |
|---|---|
| Name | 5-Trifluoromethyl-1H-2-benzothiopyran-1-one |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H5F3OS |
| InChI | InChI=1S/C10H5F3OS/c11-10(12,13)8-3-1-2-7-6(8)4-5-15-9(7)14/h1-5H |
| InChIKey | VAGSVSGGZLTFBN-UHFFFAOYSA-N |
| Molecular Weight | 230.204 g/mol |
| SMILES | C(c1c2c(C(=O)SC=C2)ccc1)(F)(F)F |
| SPLASH | splash10-0f89-0090000000-f0ebfd99fb975dfd612f |
| Source of Spectrum | F-56-6766-2 |
| Wiley ID | 858382 |