SpectraBase Compound ID | 3X7gDsElRG1 |
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InChI | InChI=1S/C8H4ClF3O2/c9-6-2-1-4(8(10,11)12)3-5(6)7(13)14/h1-3H,(H,13,14) |
InChIKey | WLXRKCGYQAKHSJ-UHFFFAOYSA-N |
Mol Weight | 224.57 g/mol |
Molecular Formula | C8H4ClF3O2 |
Exact Mass | 223.985192 g/mol |
SpectraBase Spectrum ID | 2Xk1tClXVxy |
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Name | 6-chloro-a,a,a-trifluoro-m-toluic acid |
Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C8H4ClF3O2 |
InChI | InChI=1S/C8H4ClF3O2/c9-6-2-1-4(8(10,11)12)3-5(6)7(13)14/h1-3H,(H,13,14) |
InChIKey | WLXRKCGYQAKHSJ-UHFFFAOYSA-N |
Instrument Name | Varian CFT-20 |
Sadtler NMR Number | 30717M |
Solvent | CDCl3 |