| SpectraBase Compound ID | 585e6zscPF1 |
|---|---|
| InChI | InChI=1S/C15H14F3NO3/c1-9-13(10(2)22-19-9)21-14(20)12(15(16,17)18)8-11-6-4-3-5-7-11/h3-7,12H,8H2,1-2H3 |
| InChIKey | QBYPVBKYMRBDGK-UHFFFAOYSA-N |
| Mol Weight | 313.28 g/mol |
| Molecular Formula | C15H14F3NO3 |
| Exact Mass | 313.092578 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GhsBfDuJVvi |
|---|---|
| Name | Benzenepropanoic acid, .alpha.-trifluoromethyl-, 3,5-dimethyl-4-isoxazolyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H14F3NO3 |
| InChI | InChI=1S/C15H14F3NO3/c1-9-13(10(2)22-19-9)21-14(20)12(15(16,17)18)8-11-6-4-3-5-7-11/h3-7,12H,8H2,1-2H3 |
| InChIKey | QBYPVBKYMRBDGK-UHFFFAOYSA-N |
| Molecular Weight | 313.276 g/mol |
| SMILES | c1(OC(C(C(F)(F)F)Cc2ccccc2)=O)c(onc1C)C |
| SPLASH | splash10-00di-7900000000-3134b0afa27a76553542 |
| Source of Spectrum | AD-0-2532-0 |
| Synonyms | (3,5-dimethyl-1,2-oxazol-4-yl) 2-benzyl-3,3,3-trifluoropropanoate (3,5-dimethyl-1,2-oxazol-4-yl) 3,3,3-tris(fluoranyl)-2-(phenylmethyl)propanoate (3,5-dimethylisoxazol-4-yl) 2-benzyl-3,3,3-trifluoro-propanoate 2-Benzyl-3,3,3-trifluoro-propionic acid (3,5-dimethylisoxazol-4-yl) ester 3,3,3-trifluoro-2-(phenylmethyl)propanoic acid (3,5-dimethyl-4-isoxazolyl) ester 3,5-Dimethyl-4-isoxazolyl 2-benzyl-3,3,3-trifluoropropanoate |
| Wiley ID | 1430258 |