| SpectraBase Spectrum ID |
2TGlHQvdR2z |
| Name |
N-Ethyl-N-pentyl-2,5-dimethylphenethylamine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
247.229999938 u |
| Formula |
C17H29N |
| InChI |
InChI=1S/C17H29N/c1-5-7-8-12-18(6-2)13-11-17-14-15(3)9-10-16(17)4/h9-10,14H,5-8,11-13H2,1-4H3 |
| InChIKey |
SFHSUQKBOJDHOD-UHFFFAOYSA-N |
| Molecular Weight |
247.426 g/mol |
| SMILES |
C=1(C(=CC=C(C1)C)C)CCN(CCCCC)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.917819 |
