| SpectraBase Spectrum ID |
78XNXWpzXNm |
| Name |
N-Ethyl-2-(4-fluorophenoxy)ethanamine, N-acetyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
225.116506920 u |
| Formula |
C12H16FNO2 |
| InChI |
InChI=1S/C12H16FNO2/c1-3-14(10(2)15)8-9-16-12-6-4-11(13)5-7-12/h4-7H,3,8-9H2,1-2H3 |
| InChIKey |
CXLQNVKZLOUXAB-UHFFFAOYSA-N |
| Molecular Weight |
225.263 g/mol |
| SMILES |
C1(F)=CC=C(C=C1)OCCN(CC)C(C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.849728 |
