| SpectraBase Compound ID | 7SqXHFtuF1Q |
|---|---|
| InChI | InChI=1S/C16H10F13N3O2/c1-7-5-10(34,32(31-7)9(33)8-3-2-4-30-6-8)11(17,18)12(19,20)13(21,22)14(23,24)15(25,26)16(27,28)29/h2-4,6,34H,5H2,1H3 |
| InChIKey | PLJHOQQAUAKTNL-UHFFFAOYSA-N |
| Mol Weight | 523.25 g/mol |
| Molecular Formula | C16H10F13N3O2 |
| Exact Mass | 523.056543 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Iq4yXBzHDvZ |
|---|---|
| Name | 2-Pyrazolin-5-ol, 5-tridecafluorohexyl-3-methyl-1-(3-pyridylcarbonyl)- |
| Alternate Name(s) | 3-Methyl-1-(3-pyridinylcarbonyl)-5-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)-4,5-dihydro-1H-pyrazol-5-ol [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]-pyridin-3-yl-methanone [5-hydroxy-3-methyl-5-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)-2-pyrazolin-1-yl]-(3-pyridyl)methanone [5-hydroxy-3-methyl-5-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)-4H-pyrazol-1-yl]-(3-pyridinyl)methanone [5-hydroxy-3-methyl-5-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)-4H-pyrazol-1-yl]-(3-pyridyl)methanone [5-hydroxy-3-methyl-5-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)-4H-pyrazol-1-yl]-pyridin-3-ylmethanone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H10F13N3O2 |
| InChI | InChI=1S/C16H10F13N3O2/c1-7-5-10(34,32(31-7)9(33)8-3-2-4-30-6-8)11(17,18)12(19,20)13(21,22)14(23,24)15(25,26)16(27,28)29/h2-4,6,34H,5H2,1H3 |
| InChIKey | PLJHOQQAUAKTNL-UHFFFAOYSA-N |
| Molecular Weight | 523.254 g/mol |
| SMILES | OC1(N(C(c2cnccc2)=O)N=C(C1)C)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F |
| SPLASH | splash10-0a4i-8910000000-fa2df187b5659acbb030 |
| Source of Spectrum | AD-0-2532-0 |
| Wiley ID | 1425883 |