| SpectraBase Compound ID | 9x3EVLz51G7 |
|---|---|
| InChI | InChI=1S/C7H7BrFN/c8-6-2-1-5(4-10)7(9)3-6/h1-3H,4,10H2 |
| InChIKey | RLTFBWCBGIZCDQ-UHFFFAOYSA-N |
| Mol Weight | 204.04 g/mol |
| Molecular Formula | C7H7BrFN |
| Exact Mass | 202.97459 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | A21cMZPLc31 |
|---|---|
| Name | (4-Bromo-2-fluorophenyl)methanamine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 202.974590392 u |
| Formula | C7H7BrFN |
| InChI | InChI=1S/C7H7BrFN/c8-6-2-1-5(4-10)7(9)3-6/h1-3H,4,10H2 |
| InChIKey | RLTFBWCBGIZCDQ-UHFFFAOYSA-N |
| Molecular Weight | 204.042 g/mol |
| SMILES | C1(F)=C(C=CC(=C1)Br)CN |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.829719 |