| SpectraBase Compound ID | 14JGZTfAsxl |
|---|---|
| InChI | InChI=1S/C3Cl5FO/c4-2(5,6)1(10)3(7,8)9 |
| InChIKey | VODZXUJSDKOZEW-UHFFFAOYSA-N |
| Mol Weight | 248.3 g/mol |
| Molecular Formula | C3Cl5FO |
| Exact Mass | 245.837581 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | CRHD1UZEQ9i |
|---|---|
| Name | Fluoropentachloroacetone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 245.837581282 u |
| Formula | C3Cl5FO |
| InChI | InChI=1S/C3Cl5FO/c4-2(5,6)1(10)3(7,8)9 |
| InChIKey | VODZXUJSDKOZEW-UHFFFAOYSA-N |
| Molecular Weight | 248.295 g/mol |
| SMILES | C(C(C(F)(Cl)Cl)=O)(Cl)(Cl)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.901111 |