| SpectraBase Compound ID | 6im8mEbLdfl |
|---|---|
| InChI | InChI=1S/C9H6F4O2/c10-8(11)9(12,13)15-7-3-1-2-6(4-7)5-14/h1-5,8H |
| InChIKey | LAFOZKQZOGJYKC-UHFFFAOYSA-N |
| Mol Weight | 222.14 g/mol |
| Molecular Formula | C9H6F4O2 |
| Exact Mass | 222.030392 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 3Wx6iq7pCVo |
|---|---|
| Name | 3-(1,1,2,2-Tetrafluoroethoxy)benzaldehyde |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 222.030392083 u |
| Formula | C9H6F4O2 |
| InChI | InChI=1S/C9H6F4O2/c10-8(11)9(12,13)15-7-3-1-2-6(4-7)5-14/h1-5,8H |
| InChIKey | LAFOZKQZOGJYKC-UHFFFAOYSA-N |
| Molecular Weight | 222.139 g/mol |
| SMILES | C(F)(C(F)F)(OC1=CC(C=O)=CC=C1)F |
| Spectrum/Structure Validation Score (Raman) | 0.716138 |