SpectraBase Spectrum ID |
4fzOA3orxR7 |
Name |
N-[3-(4-Fluorophenoxy)propyl]-N-methylamine, 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(2)8-3-9-16-12-6-4-11(13)5-7-12/h4-7H,3,8-9H2,1-2H3 |
InChIKey |
RMCZPVWSHCGVSJ-UHFFFAOYSA-N |
Molecular Weight |
225.263 g/mol |
SMILES |
C1(F)=CC=C(C=C1)OCCCN(C)C(C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.91184 |