| SpectraBase Spectrum ID |
LxnhIKiKviw |
| Name |
N-(5'-Hydroxypentyl)-2-hydroxyacetophenonimine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
221.141578854 u |
| Formula |
C13H19NO2 |
| InChI |
InChI=1S/C13H19NO2/c1-11(14-9-5-2-6-10-15)12-7-3-4-8-13(12)16/h3-4,7-8,15-16H,2,5-6,9-10H2,1H3/b14-11- |
| InChIKey |
LCBIKPYFIRLAIA-KAMYIIQDSA-N |
| Molecular Weight |
221.300 g/mol |
| SMILES |
C=1(\C(=N/CCCCCO)C)C(O)=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.82098 |
