| SpectraBase Compound ID | 5h2nRd7O5c5 |
|---|---|
| InChI | InChI=1S/C14H12F6N2OS/c1-8-10(24-14(19,20)12(15)13(16,17)18)11(23)22(21(8)2)9-6-4-3-5-7-9/h3-7,12H,1-2H3 |
| InChIKey | QQSNXCCQBJRRGW-UHFFFAOYSA-N |
| Mol Weight | 370.31 g/mol |
| Molecular Formula | C14H12F6N2OS |
| Exact Mass | 370.057453 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8qHLbikBDOb |
|---|---|
| Name | 4-(1,1,2,3,3,3-Hexafluoro-propylsulfanyl)-1,5-dimethyl-2-phenyl-1,2-dihydro-pyrazol-3-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H12F6N2OS |
| InChI | InChI=1S/C14H12F6N2OS/c1-8-10(24-14(19,20)12(15)13(16,17)18)11(23)22(21(8)2)9-6-4-3-5-7-9/h3-7,12H,1-2H3 |
| InChIKey | QQSNXCCQBJRRGW-UHFFFAOYSA-N |
| Molecular Weight | 370.313 g/mol |
| SMILES | C=1(C(N(c2ccccc2)N(C1C)C)=O)SC(C(C(F)(F)F)F)(F)F |
| SPLASH | splash10-0a4i-9010000000-83e4648c62d85bbbc0da |
| Synonyms | 4-(1,1,2,3,3,3-hexafluoropropylsulfanyl)-1,5-dimethyl-2-phenyl-pyrazol-3-one 4-(1,1,2,3,3,3-hexafluoropropylthio)-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one 4-(1,1,2,3,3,3-hexafluoropropylthio)-1,5-dimethyl-2-phenyl-3-pyrazolone 4-[(1,1,2,3,3,3-Hexafluoropropyl)sulfanyl]-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one 4-[1,1,2,3,3,3-hexakis(fluoranyl)propylsulfanyl]-1,5-dimethyl-2-phenyl-pyrazol-3-one |
| Wiley ID | 1464061 |