| SpectraBase Spectrum ID |
5XBW1gOaXc3 |
| Name |
N,N-Diethyl-2-(4'-hydroxy-1'-oxopentyl)-4-methoxybenzamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
307.178358285 u |
| Formula |
C17H25NO4 |
| InChI |
InChI=1S/C17H25NO4/c1-5-18(6-2)17(21)14-9-8-13(22-4)11-15(14)16(20)10-7-12(3)19/h8-9,11-12,19H,5-7,10H2,1-4H3 |
| InChIKey |
LZVDMEZGSQPICF-UHFFFAOYSA-N |
| Molecular Weight |
307.390 g/mol |
| SMILES |
C=1(C(N(CC)CC)=O)C(C(=O)CCC(O)C)=CC(=CC1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.862223 |
