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 |
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 |