| SpectraBase Spectrum ID |
1VEMWEv40Wy |
| Name |
alpha-Phenethyl-o-(2-piperidinoethoxy)benzyl alcohol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
339.219829176 u |
| Formula |
C22H29NO2 |
| InChI |
InChI=1S/C22H29NO2/c24-21(14-13-19-9-3-1-4-10-19)20-11-5-6-12-22(20)25-18-17-23-15-7-2-8-16-23/h1,3-6,9-12,21,24H,2,7-8,13-18H2 |
| InChIKey |
IUKXXGXHFJWJHV-UHFFFAOYSA-N |
| Molecular Weight |
339.479 g/mol |
| SMILES |
OC(CCC1=CC=CC=C1)C=1C=CC=CC1OCCN1CCCCC1 |
| Spectrum/Structure Validation Score (Raman) |
0.960348 |