| SpectraBase Compound ID | AVMm1snQoxn |
|---|---|
| InChI | InChI=1S/C8H8F3NO4/c1-16-6(14)7(15,8(9,10)11)4-5(13)2-3-12/h15H,2,4H2,1H3 |
| InChIKey | YQPKBNAYVCQGFK-UHFFFAOYSA-N |
| Mol Weight | 239.15 g/mol |
| Molecular Formula | C8H8F3NO4 |
| Exact Mass | 239.040542 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BWwuYFsEyv |
|---|---|
| Name | Methyl 5-cyano-2-hydroxy-4-oxo-2-(trifluoromethyl)pentanoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H8F3NO4 |
| InChI | InChI=1S/C8H8F3NO4/c1-16-6(14)7(15,8(9,10)11)4-5(13)2-3-12/h15H,2,4H2,1H3 |
| InChIKey | YQPKBNAYVCQGFK-UHFFFAOYSA-N |
| Molecular Weight | 239.150 g/mol |
| SMILES | OC(C(=O)OC)(CC(CC#N)=O)C(F)(F)F |
| SPLASH | splash10-0aou-9300000000-28d04131c5fdeb0ad67e |
| Source of Spectrum | C5-2004-2548-11 |
| Wiley ID | 1617458 |