| SpectraBase Compound ID | Bz4IoQh5XWT |
|---|---|
| InChI | InChI=1S/C12H13F3O/c1-2-3-4-9-5-7-10(8-6-9)11(16)12(13,14)15/h5-8H,2-4H2,1H3 |
| InChIKey | XIVOMWSWGCFRNB-UHFFFAOYSA-N |
| Mol Weight | 230.23 g/mol |
| Molecular Formula | C12H13F3O |
| Exact Mass | 230.09185 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 18Ypa4SpBAO |
|---|---|
| Name | ETHANONE, 1-(4-BUTYLPHENYL)-2,2,2-TRIFLUORO- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H13OF3 |
| InChI | InChI=1S/C12H13F3O/c1-2-3-4-9-5-7-10(8-6-9)11(16)12(13,14)15/h5-8H,2-4H2,1H3 |
| InChIKey | XIVOMWSWGCFRNB-UHFFFAOYSA-N |
| Molecular Weight | 230.0915 |
| SMILES | CCCCc1ccc(C(C(F)(F)F)=O)cc1 |
| SPLASH | splash10-03di-7900000000-45d8d012b7617bdee5ee |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |