| SpectraBase Compound ID | jKBa5fIXQ7 |
|---|---|
| InChI | InChI=1S/C8H5FO2/c9-6-2-1-5-4-11-8(10)7(5)3-6/h1-3H,4H2 |
| InChIKey | LRPVIFOWOOZXEW-UHFFFAOYSA-N |
| Mol Weight | 152.12 g/mol |
| Molecular Formula | C8H5FO2 |
| Exact Mass | 152.027358 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | AMriCcHGpyy |
|---|---|
| Name | 6-Fluorophthalide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 152.027357562 u |
| Formula | C8H5FO2 |
| InChI | InChI=1S/C8H5FO2/c9-6-2-1-5-4-11-8(10)7(5)3-6/h1-3H,4H2 |
| InChIKey | LRPVIFOWOOZXEW-UHFFFAOYSA-N |
| Molecular Weight | 152.124 g/mol |
| SMILES | C=12C=CC(=CC1C(OC2)=O)F |
| Spectrum/Structure Validation Score (Raman) | 0.816616 |