| SpectraBase Spectrum ID |
IM3zpY5XdX |
| Name |
N,N-Ethyl-hexyl-3,4-dimethoxyphenethylamine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
293.235479240 u |
| Formula |
C18H31NO2 |
| InChI |
InChI=1S/C18H31NO2/c1-5-7-8-9-13-19(6-2)14-12-16-10-11-17(20-3)18(15-16)21-4/h10-11,15H,5-9,12-14H2,1-4H3 |
| InChIKey |
YKOWVBOFILRLTM-UHFFFAOYSA-N |
| SMILES |
C1(=C(C=CC(=C1)CCN(CCCCCC)CC)OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.907546 |