| SpectraBase Compound ID | 97a8dHHlAD9 |
|---|---|
| InChI | InChI=1S/C7H7F2NO/c8-7(9)11-6-3-1-2-5(10)4-6/h1-4,7H,10H2 |
| InChIKey | RSOFZRXRIPVBBM-UHFFFAOYSA-N |
| Mol Weight | 159.14 g/mol |
| Molecular Formula | C7H7F2NO |
| Exact Mass | 159.04957 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | KSAdgqmtfbN |
|---|---|
| Name | 3-(Difluoromethoxy)aniline |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 159.049570174 u |
| Formula | C7H7F2NO |
| InChI | InChI=1S/C7H7F2NO/c8-7(9)11-6-3-1-2-5(10)4-6/h1-4,7H,10H2 |
| InChIKey | RSOFZRXRIPVBBM-UHFFFAOYSA-N |
| Molecular Weight | 159.136 g/mol |
| SMILES | C(F)(OC1=CC(N)=CC=C1)F |
| Spectrum/Structure Validation Score (Raman) | 0.962268 |