| SpectraBase Spectrum ID |
8cqb1n6HubN |
| Name |
1-Propanone, 3-(2-hydroxy-3,4-dimethylphenyl)-1-(4-morpholyl)-3-phenyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
339.183443666 u |
| Formula |
C21H25NO3 |
| InChI |
InChI=1S/C21H25NO3/c1-15-8-9-18(21(24)16(15)2)19(17-6-4-3-5-7-17)14-20(23)22-10-12-25-13-11-22/h3-9,19,24H,10-14H2,1-2H3 |
| InChIKey |
VJIWODYAMUAWOL-UHFFFAOYSA-N |
| Molecular Weight |
339.435 g/mol |
| SMILES |
C1(=C(C(C)=C(C=C1)C)O)C(CC(N1CCOCC1)=O)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.93453 |
