| SpectraBase Compound ID | h6yemLKqdW |
|---|---|
| InChI | InChI=1S/C8H11ClF2O2/c1-2-3-4-5-6-13-7(12)8(9,10)11/h2H,1,3-6H2 |
| InChIKey | PFCPUXZRYWFFNY-UHFFFAOYSA-N |
| Mol Weight | 212.62 g/mol |
| Molecular Formula | C8H11ClF2O2 |
| Exact Mass | 212.041564 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | bs1g0xU81p |
|---|---|
| Name | 5-Hexen-1-ol, chlorodifluoroacetate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.041563618 u |
| Formula | C8H11ClF2O2 |
| InChI | InChI=1S/C8H11ClF2O2/c1-2-3-4-5-6-13-7(12)8(9,10)11/h2H,1,3-6H2 |
| InChIKey | PFCPUXZRYWFFNY-UHFFFAOYSA-N |
| Molecular Weight | 212.624 g/mol |
| SMILES | C=CCCCCOC(C(F)(F)Cl)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.857726 |