| SpectraBase Spectrum ID |
AbF6LbGTFEs |
| Name |
2-Phenyl-4,5-dipropyl-2-oxazoline |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
231.162314299 u |
| Formula |
C15H21NO |
| InChI |
InChI=1S/C15H21NO/c1-3-8-13-14(9-4-2)17-15(16-13)12-10-6-5-7-11-12/h5-7,10-11,13-14H,3-4,8-9H2,1-2H3 |
| InChIKey |
CBWHETZZDBZHTH-UHFFFAOYSA-N |
| Molecular Weight |
231.339 g/mol |
| SMILES |
C1(=NC(CCC)C(O1)CCC)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.951314 |
