| SpectraBase Compound ID | 3UBapQvWsDE |
|---|---|
| InChI | InChI=1S/C8H10FNO/c9-7-5-6(3-4-10)1-2-8(7)11/h1-2,5,11H,3-4,10H2 |
| InChIKey | MBQWGRWJFUWYAA-UHFFFAOYSA-N |
| Mol Weight | 155.17 g/mol |
| Molecular Formula | C8H10FNO |
| Exact Mass | 155.074642 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 17zJgJVWwE0 |
|---|---|
| Name | Benzeneethanamine, 3-fluoro-4-hydroxy- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 155.074642108 u |
| Formula | C8H10FNO |
| InChI | InChI=1S/C8H10FNO/c9-7-5-6(3-4-10)1-2-8(7)11/h1-2,5,11H,3-4,10H2 |
| InChIKey | MBQWGRWJFUWYAA-UHFFFAOYSA-N |
| Molecular Weight | 155.172 g/mol |
| SMILES | C1=C(C=CC(=C1F)O)CCN |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.93959 |