| SpectraBase Compound ID | 1WMwqBIHwwl |
|---|---|
| InChI | InChI=1S/C17H11F13N2O3/c1-7-6-11(35,32(31-7)10(34)8-4-2-3-5-9(8)33)12(18,19)13(20,21)14(22,23)15(24,25)16(26,27)17(28,29)30/h2-5,33,35H,6H2,1H3 |
| InChIKey | DEDFZEODOTXYTL-UHFFFAOYSA-N |
| Mol Weight | 538.27 g/mol |
| Molecular Formula | C17H11F13N2O3 |
| Exact Mass | 538.056208 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HQo13QKpps4 |
|---|---|
| Name | 2-Pyrazolin-5-ol, 5-tridecafluorohexyl-1-(2-hydroxybenzoyl)-3-methyl- |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H11F13N2O3 |
| InChI | InChI=1S/C17H11F13N2O3/c1-7-6-11(35,32(31-7)10(34)8-4-2-3-5-9(8)33)12(18,19)13(20,21)14(22,23)15(24,25)16(26,27)17(28,29)30/h2-5,33,35H,6H2,1H3 |
| InChIKey | DEDFZEODOTXYTL-UHFFFAOYSA-N |
| Molecular Weight | 538.265 g/mol |
| SMILES | Oc1c(C(N2C(CC(=N2)C)(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O)=O)cccc1 |
| SPLASH | splash10-00di-8900000000-b248ae31fe9d02bd5674 |
| Source of Spectrum | AD-0-2532-0 |
| Synonyms | (2-hydroxyphenyl)-[3-methyl-5-oxidanyl-5-[1,1,2,2,3,3,4,4,5,5,6,6,6-tridecakis(fluoranyl)hexyl]-4H-pyrazol-1-yl]methanone 1-(2-Hydroxybenzoyl)-3-methyl-5-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)-4,5-dihydro-1H-pyrazol-5-ol [5-hydroxy-3-methyl-5-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)-2-pyrazolin-1-yl]-(2-hydroxyphenyl)methanone [5-hydroxy-3-methyl-5-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)-4H-pyrazol-1-yl]-(2-hydroxyphenyl)methanone |
| Wiley ID | 1425793 |