| SpectraBase Compound ID | 40ghftaTAKR |
|---|---|
| InChI | InChI=1S/C9H6F3NO2/c10-9(11,12)8(15)4-7(14)6-2-1-3-13-5-6/h1-3,5H,4H2 |
| InChIKey | MXVYPMBHALRMDU-UHFFFAOYSA-N |
| Mol Weight | 217.15 g/mol |
| Molecular Formula | C9H6F3NO2 |
| Exact Mass | 217.035063 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GfDFglP7hJs |
|---|---|
| Name | 1,3-Butanedione, 4,4,4-trifluoro-1-(3-pyridinyl)- |
| Alternate Name(s) | 4,4,4-Trifluoro-1-(3-pyridinyl)-1,3-butanedione 1,3-Butanedione, 4,4,4-trifluoro-1-(3-pyridyl)- 4,4,4-trifluoro-1-(3-pyridinyl)butane-1,3-dione 4,4,4-Trifluoro-1-(3-pyridyl)-1,3-butanedione 4,4,4-trifluoro-1-(3-pyridyl)butane-1,3-dione 4,4,4-trifluoro-1-pyridin-3-ylbutane-1,3-dione 4,4,4-tris(fluoranyl)-1-pyridin-3-yl-butane-1,3-dione Butane-1,3-dione, 4,4,4-trifluoro-1-(3-pyridyl)- NSC 42763 |
| CAS Registry Number | 582-73-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H6F3NO2 |
| InChI | InChI=1S/C9H6F3NO2/c10-9(11,12)8(15)4-7(14)6-2-1-3-13-5-6/h1-3,5H,4H2 |
| InChIKey | MXVYPMBHALRMDU-UHFFFAOYSA-N |
| Molecular Weight | 217.147 g/mol |
| SMILES | C(C(CC(c1cnccc1)=O)=O)(F)(F)F |
| SPLASH | splash10-0gba-9510000000-4ea3b0944226c36c4e8a |
| Source of Spectrum | O-3-1241-2 |
| Wiley ID | 27553 |