SpectraBase Spectrum ID |
GKYzihLzikT |
Name |
4-(3-(Benzylamino)butyl)-2-methoxyphenol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
285.172878983 u |
Formula |
C18H23NO2 |
InChI |
InChI=1S/C18H23NO2/c1-14(19-13-16-6-4-3-5-7-16)8-9-15-10-11-17(20)18(12-15)21-2/h3-7,10-12,14,19-20H,8-9,13H2,1-2H3 |
InChIKey |
GEKRZHUGDNWIIB-UHFFFAOYSA-N |
SMILES |
C1(=CC=CC=C1)CNC(CCC1=CC=C(O)C(OC)=C1)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.967359 |