| SpectraBase Compound ID | DT84jwp7OVs |
|---|---|
| InChI | InChI=1S/C15H10ClF6NO3/c1-2-25-12(24)9-10(8-6-4-3-5-7-8)23-26-11(9)13(17,18)14(19,20)15(16,21)22/h3-7H,2H2,1H3 |
| InChIKey | QZJSIOYBYUUOHA-UHFFFAOYSA-N |
| Mol Weight | 401.69 g/mol |
| Molecular Formula | C15H10ClF6NO3 |
| Exact Mass | 401.02534 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1ADNTnCNztO |
|---|---|
| Name | 5-(3-Chloro-1,1,2,2,3,3-hexafluoro-propyl)-3-phenyl-isoxazole-4-carboxylic acid ethyl ester |
| Alternate Name(s) | 5-(3-Chloro-1,1,2,2,3,3-hexafluoropropyl)-3-phenyl-4-isoxazolecarboxylic acid ethyl ester Ethyl 5-(3-chloro-1,1,2,2,3,3-hexafluoro-propyl)-3-phenyl-isoxazole-4-carboxylate Ethyl 5-(3-chloro-1,1,2,2,3,3-hexafluoropropyl)-3-phenyl-1,2-oxazole-4-carboxylate Ethyl 5-[3-chloranyl-1,1,2,2,3,3-hexakis(fluoranyl)propyl]-3-phenyl-1,2-oxazole-4-carboxylate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H10ClF6NO3 |
| InChI | InChI=1S/C15H10ClF6NO3/c1-2-25-12(24)9-10(8-6-4-3-5-7-8)23-26-11(9)13(17,18)14(19,20)15(16,21)22/h3-7H,2H2,1H3 |
| InChIKey | QZJSIOYBYUUOHA-UHFFFAOYSA-N |
| Molecular Weight | 401.692 g/mol |
| SMILES | c1(noc(c1C(=O)OCC)C(C(C(F)(F)Cl)(F)F)(F)F)-c1ccccc1 |
| SPLASH | splash10-11or-3756900000-374bc64a76dcc2e738dd |
| Source of Spectrum | KC-57-5783-6 |
| Wiley ID | 1624882 |