| SpectraBase Compound ID | 3NCF7ESWunv |
|---|---|
| InChI | InChI=1S/C9H7F3O/c1-13-7-4-2-6(3-5-7)8(10)9(11)12/h2-5H,1H3 |
| InChIKey | YLLQIDCUHCPHJL-UHFFFAOYSA-N |
| Mol Weight | 188.15 g/mol |
| Molecular Formula | C9H7F3O |
| Exact Mass | 188.044899 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | boBnpKKDAA |
|---|---|
| Name | Benzene, 1-methoxy-4-(trifluoroethenyl)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 188.044899333 u |
| Formula | C9H7F3O |
| InChI | InChI=1S/C9H7F3O/c1-13-7-4-2-6(3-5-7)8(10)9(11)12/h2-5H,1H3 |
| InChIKey | YLLQIDCUHCPHJL-UHFFFAOYSA-N |
| Molecular Weight | 188.149 g/mol |
| SMILES | C(=C(F)F)(C=1C=CC(=CC1)OC)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.903446 |