| SpectraBase Compound ID | JvJBSXxaaXU |
|---|---|
| InChI | InChI=1S/C9H5F3/c1-2-7-3-5-8(6-4-7)9(10,11)12/h1,3-6H |
| InChIKey | XTKBMZQCDBHHKY-UHFFFAOYSA-N |
| Mol Weight | 170.13 g/mol |
| Molecular Formula | C9H5F3 |
| Exact Mass | 170.034335 g/mol |
Attenuated Total Reflectance Infrared (ATR-IR) Spectrum
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| SpectraBase Spectrum ID | JRbUKfhHRHD |
|---|---|
| Name | 4-Ethynyl-alpha,alpha,alpha-trifluorotoluene |
| Source of Sample | Aldrich |
| Catalog Number | 556432 |
| CAS Registry Number | 705-31-7 |
| Copyright | Copyright © 2018-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H5F3 |
| InChI | InChI=1S/C9H5F3/c1-2-7-3-5-8(6-4-7)9(10,11)12/h1,3-6H |
| InChIKey | XTKBMZQCDBHHKY-UHFFFAOYSA-N |
| Purity | 97% |
| Wiley ID | SIAL_ATR-IR_021430 |