SpectraBase Spectrum ID |
Bqnh2DkgyMG |
Name |
1-oxo-3-Morpholino-1-phenyl-2-propene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
217.110278725 u |
Formula |
C13H15NO2 |
InChI |
InChI=1S/C13H15NO2/c15-13(12-4-2-1-3-5-12)6-7-14-8-10-16-11-9-14/h1-7H,8-11H2/b7-6+ |
InChIKey |
GTAHTHUGNVIJEK-VOTSOKGWSA-N |
Molecular Weight |
217.268 g/mol |
SMILES |
C(=O)(C=1C=CC=CC1)\C=C\N1CCOCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.966752 |