![2-[4-(2-Fluoroethoxy)-3,5-dimethoxyphenyl]ethan-1-amine](/api/spectrum/J4le1PP7ASL/structure.png?h=300&w=458 "2-[4-(2-Fluoroethoxy)-3,5-dimethoxyphenyl]ethan-1-amine")
| SpectraBase Compound ID | 7AS1P3XRPr8 |
|---|---|
| InChI | InChI=1S/C12H18FNO3/c1-15-10-7-9(3-5-14)8-11(16-2)12(10)17-6-4-13/h7-8H,3-6,14H2,1-2H3 |
| InChIKey | RODJFRFKJSPAGG-UHFFFAOYSA-N |
| Mol Weight | 243.28 g/mol |
| Molecular Formula | C12H18FNO3 |
| Exact Mass | 243.127072 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | J4le1PP7ASL |
|---|---|
| Name | fe |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 243.127071604 u |
| Formula | C12H18FNO3 |
| InChI | InChI=1S/C12H18FNO3/c1-15-10-7-9(3-5-14)8-11(16-2)12(10)17-6-4-13/h7-8H,3-6,14H2,1-2H3 |
| InChIKey | RODJFRFKJSPAGG-UHFFFAOYSA-N |
| Molecular Weight | 243.278 g/mol |
| SMILES | C=1(C(=CC(=CC1OC)CCN)OC)OCCF |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.954854 |