SpectraBase Spectrum ID |
6DqHRR5yVA7 |
Name |
Tetrahydropyran-4-carboxylic acid, 4-phenyl-, (4-acetylphenyl)amide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
323.152143537 u |
Formula |
C20H21NO3 |
InChI |
InChI=1S/C20H21NO3/c1-15(22)16-7-9-18(10-8-16)21-19(23)20(11-13-24-14-12-20)17-5-3-2-4-6-17/h2-10H,11-14H2,1H3,(H,21,23) |
InChIKey |
GIHVMAFRQAUUIB-UHFFFAOYSA-N |
Molecular Weight |
323.392 g/mol |
SMILES |
C(C1(C=2C=CC=CC2)CCOCC1)(NC=1C=CC(C(=O)C)=CC1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.942723 |