| SpectraBase Spectrum ID |
DrB7laXdQ4J |
| Name |
N-[(3'-Benzyloxy)-4'-methoxyphenethyl]-(p-hydroxyphenyl)-propanamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
405.194008349 u |
| Formula |
C25H27NO4 |
| InChI |
InChI=1S/C25H27NO4/c1-29-23-13-9-20(17-24(23)30-18-21-5-3-2-4-6-21)15-16-26-25(28)14-10-19-7-11-22(27)12-8-19/h2-9,11-13,17,27H,10,14-16,18H2,1H3,(H,26,28) |
| InChIKey |
CEFZWRXOGFZIPM-UHFFFAOYSA-N |
| Molecular Weight |
405.494 g/mol |
| SMILES |
C1(OCC2=CC=CC=C2)=C(C=CC(=C1)CCNC(=O)CCC1=CC=C(C=C1)O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.883115 |