| SpectraBase Compound ID | D6Jn2dnQNXi |
|---|---|
| InChI | InChI=1S/C12H7F3O5S/c1-17-10(16)9(12(13,14)15)11-20-7-2-5-6(19-4-18-5)3-8(7)21-11/h2-3H,4H2,1H3/b11-9+ |
| InChIKey | GKOGIBVIGYQYIH-PKNBQFBNSA-N |
| Mol Weight | 320.24 g/mol |
| Molecular Formula | C12H7F3O5S |
| Exact Mass | 319.996629 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AUD2y1TBfQu |
|---|---|
| Name | 3,3,3-Trifluoro-2-(1,3,5-trioxa-7-thia-S-indacen-6-ylidene)-propionic acid methyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H7F3O5S |
| InChI | InChI=1S/C12H7F3O5S/c1-17-10(16)9(12(13,14)15)11-20-7-2-5-6(19-4-18-5)3-8(7)21-11/h2-3H,4H2,1H3/b11-9+ |
| InChIKey | GKOGIBVIGYQYIH-PKNBQFBNSA-N |
| Molecular Weight | 320.238 g/mol |
| SMILES | C(\C(=C\1Sc2cc3OCOc3cc2O1)C(=O)OC)(F)(F)F |
| SPLASH | splash10-00di-9688000000-2004935bf2363ff32920 |
| Synonyms | (2E)-2-([1,3]dioxolo[4,5-f][1,3]benzoxathiol-6-ylidene)-3,3,3-trifluoro-propionic acid methyl ester (2E)-2-([1,3]dioxolo[4,5-f][1,3]benzoxathiol-6-ylidene)-3,3,3-trifluoropropanoic acid methyl ester Methyl (2E)-2-([1,3]dioxolo[4,5-f][1,3]benzoxathiol-6-ylidene)-3,3,3-trifluoro-propanoate Methyl (2E)-2-([1,3]dioxolo[4,5-f][1,3]benzoxathiol-6-ylidene)-3,3,3-tris(fluoranyl)propanoate |
| Wiley ID | 1464054 |