SpectraBase Spectrum ID |
GhKXIEYzaSx |
Name |
N-(4-Fluorobenzyl)-2-methoxyethanamine, 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/c1-10(15)14(7-8-16-2)9-11-3-5-12(13)6-4-11/h3-6H,7-9H2,1-2H3 |
InChIKey |
UOZLWXYDPIZIAU-UHFFFAOYSA-N |
Molecular Weight |
225.263 g/mol |
SMILES |
C(N(CCOC)C(C)=O)C1=CC=C(C=C1)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.903674 |