| SpectraBase Spectrum ID |
ESMuPG0POj1 |
| Name |
Phenol, o-[4-[1-cycloazapropyl]-N-butyl]-2,6-dimethyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
219.162314299 u |
| Formula |
C14H21NO |
| InChI |
InChI=1S/C14H21NO/c1-12-6-5-7-13(2)14(12)16-11-4-3-8-15-9-10-15/h5-7H,3-4,8-11H2,1-2H3 |
| InChIKey |
CPOUNCISHPEPRD-UHFFFAOYSA-N |
| Molecular Weight |
219.328 g/mol |
| SMILES |
C1(=C(C=CC=C1C)C)OCCCCN1CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.918002 |
![Phenol, o-[4-[1-cycloazapropyl]-N-butyl]-2,6-dimethyl-](/api/spectrum/ESMuPG0POj1/structure.png?h=300&w=458 "Phenol, o-[4-[1-cycloazapropyl]-N-butyl]-2,6-dimethyl-")
