| SpectraBase Spectrum ID |
7lJNiMdFwp9 |
| Name |
4'-[2-Benzyloxy)ethoxy]-2-[3-(tetrahydropyran-2-yloxy)phenyl]-2-(2-pyridyl)acetophenone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
551.267173290 u |
| Formula |
C35H37NO5 |
| InChI |
InChI=1S/C35H37NO5/c37-35(29-13-15-30(16-14-29)40-24-23-39-26-28-7-2-1-3-8-28)33(34-11-4-5-20-36-34)17-12-27-9-6-10-32(25-27)41-31-18-21-38-22-19-31/h1-11,13-16,20,25,31,33H,12,17-19,21-24,26H2 |
| InChIKey |
AWWFSPIDIVKLJZ-UHFFFAOYSA-N |
| Molecular Weight |
551.683 g/mol |
| SMILES |
C(C(C=1C=CC(=CC1)OCCOCC1=CC=CC=C1)=O)(CCC=1C=C(OC2CCOCC2)C=CC1)C1=NC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.962256 |
![4'-[2-Benzyloxy)ethoxy]-2-[3-(tetrahydropyran-2-yloxy)phenyl]-2-(2-pyridyl)acetophenone](/api/spectrum/7lJNiMdFwp9/structure.png?h=300&w=458 "4'-[2-Benzyloxy)ethoxy]-2-[3-(tetrahydropyran-2-yloxy)phenyl]-2-(2-pyridyl)acetophenone")
