| SpectraBase Compound ID | G2b2YUF2C5g |
|---|---|
| InChI | InChI=1S/C8H7F2NO/c1-11-8(12)7-5(9)3-2-4-6(7)10/h2-4H,1H3,(H,11,12) |
| InChIKey | CPTKLNRTRAMDEN-UHFFFAOYSA-N |
| Mol Weight | 171.15 g/mol |
| Molecular Formula | C8H7F2NO |
| Exact Mass | 171.04957 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 9nmjsX5WI9p |
|---|---|
| Name | Benzamide, 2,6-difluoro-N-methyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 171.049570174 u |
| Formula | C8H7F2NO |
| InChI | InChI=1S/C8H7F2NO/c1-11-8(12)7-5(9)3-2-4-6(7)10/h2-4H,1H3,(H,11,12) |
| InChIKey | CPTKLNRTRAMDEN-UHFFFAOYSA-N |
| Molecular Weight | 171.147 g/mol |
| SMILES | C1(=C(C(=CC=C1)F)C(NC)=O)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.883053 |