SpectraBase Spectrum ID |
JtAx7G7VXAl |
Name |
(3,4-Dimethoxyphenyl)hexylamine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
237.172878983 u |
Formula |
C14H23NO2 |
InChI |
InChI=1S/C14H23NO2/c1-16-13-9-8-12(11-14(13)17-2)7-5-3-4-6-10-15/h8-9,11H,3-7,10,15H2,1-2H3 |
InChIKey |
ATMNPBMTIDZMHQ-UHFFFAOYSA-N |
Molecular Weight |
237.343 g/mol |
SMILES |
C1(=CC(=CC=C1OC)CCCCCCN)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.941478 |