| SpectraBase Compound ID | 3Gd3LNLRLGu |
|---|---|
| InChI | InChI=1S/C7H8BrNO/c8-6-3-5(4-10)1-2-7(6)9/h1-3,10H,4,9H2 |
| InChIKey | ZYUUROXGZLAEQH-UHFFFAOYSA-N |
| Mol Weight | 202.05 g/mol |
| Molecular Formula | C7H8BrNO |
| Exact Mass | 200.978927 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 5YUhbVwhhTb |
|---|---|
| Name | (4-Amino-3-bromo-phenyl)-methanol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 200.978926881 u |
| Formula | C7H8BrNO |
| InChI | InChI=1S/C7H8BrNO/c8-6-3-5(4-10)1-2-7(6)9/h1-3,10H,4,9H2 |
| InChIKey | ZYUUROXGZLAEQH-UHFFFAOYSA-N |
| Molecular Weight | 202.051 g/mol |
| SMILES | C=1(C(=CC(CO)=CC1)Br)N |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.942809 |