![2H-1-benzopyran-2-one, 3-[(1,1,2,3,3,3-hexafluoropropyl)thio]-4-hydroxy-](/api/spectrum/2po3La8UkEd/structure.png?h=300&w=458 "2H-1-benzopyran-2-one, 3-[(1,1,2,3,3,3-hexafluoropropyl)thio]-4-hydroxy-")
| SpectraBase Compound ID | B4lOlcwpmvT |
|---|---|
| InChI | InChI=1S/C12H6F6O3S/c13-10(11(14,15)16)12(17,18)22-8-7(19)5-3-1-2-4-6(5)21-9(8)20/h1-4,10,19H |
| InChIKey | CYVJSJILZQKBIU-UHFFFAOYSA-N |
| Mol Weight | 344.23 g/mol |
| Molecular Formula | C12H6F6O3S |
| Exact Mass | 343.994184 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2po3La8UkEd |
|---|---|
| Name | 3-(1,1,2,3,3,3-Hexafluoro-propylsulfanyl)-4-hydroxy-chromen-2-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H6F6O3S |
| InChI | InChI=1S/C12H6F6O3S/c13-10(11(14,15)16)12(17,18)22-8-7(19)5-3-1-2-4-6(5)21-9(8)20/h1-4,10,19H |
| InChIKey | CYVJSJILZQKBIU-UHFFFAOYSA-N |
| Molecular Weight | 344.227 g/mol |
| SMILES | OC1=C(C(Oc2ccccc12)=O)SC(C(C(F)(F)F)F)(F)F |
| SPLASH | splash10-00xu-9801000000-dce32257f0436959e2ff |
| Synonyms | 3-[(1,1,2,3,3,3-Hexafluoropropyl)sulfanyl]-4-hydroxy-2H-chromen-2-one 3-(1,1,2,3,3,3-hexafluoropropylthio)-4-hydroxy-1-benzopyran-2-one 3-(1,1,2,3,3,3-hexafluoropropylsulfanyl)-4-hydroxychromen-2-one 3-(1,1,2,3,3,3-hexafluoropropylsulfanyl)-4-hydroxy-chromen-2-one 3-[1,1,2,3,3,3-hexakis(fluoranyl)propylsulfanyl]-4-oxidanyl-chromen-2-one |
| Wiley ID | 1464058 |