| SpectraBase Spectrum ID |
CA6r0qS6fB6 |
| Name |
1-Propanamine, 2-(2,6-dimethylphenoxy)-; 2-(2,6-xylyloxy)propylamine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
179.131014170 u |
| Formula |
C11H17NO |
| InChI |
InChI=1S/C11H17NO/c1-8-5-4-6-9(2)11(8)13-10(3)7-12/h4-6,10H,7,12H2,1-3H3 |
| InChIKey |
ILXUQFOWTYCVEK-UHFFFAOYSA-N |
| Molecular Weight |
179.263 g/mol |
| SMILES |
NCC(OC1=C(C=CC=C1C)C)C |
| Spectrum/Structure Validation Score (Raman) |
0.8902 |