SpectraBase Spectrum ID |
CxDAaUSNAO1 |
Name |
1-(4-Acetoxyphenyl)-3-morpholino-propan-1-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
277.131408092 u |
Formula |
C15H19NO4 |
InChI |
InChI=1S/C15H19NO4/c1-12(17)20-14-4-2-13(3-5-14)15(18)6-7-16-8-10-19-11-9-16/h2-5H,6-11H2,1H3 |
InChIKey |
OSYRMQWCHGIYRE-UHFFFAOYSA-N |
SMILES |
C1(=CC=C(C=C1)OC(C)=O)C(CCN1CCOCC1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.846558 |