| SpectraBase Spectrum ID |
7bRCZDYuP8 |
| Name |
2-Cyclohexen-1-one, 2-[2-(3,4-diethoxyphenyl)acetyl]-3-[(3-methoxyphenyl)amino]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
423.204573033 u |
| Formula |
C25H29NO5 |
| InChI |
InChI=1S/C25H29NO5/c1-4-30-23-13-12-17(15-24(23)31-5-2)14-22(28)25-20(10-7-11-21(25)27)26-18-8-6-9-19(16-18)29-3/h6,8-9,12-13,15-16,26H,4-5,7,10-11,14H2,1-3H3 |
| InChIKey |
RRTPVGPTKWPPGZ-UHFFFAOYSA-N |
| Molecular Weight |
423.509 g/mol |
| SMILES |
C1(=C(NC=2C=C(OC)C=CC2)CCCC1=O)C(CC=1C=C(OCC)C(=CC1)OCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.804877 |
![2-Cyclohexen-1-one, 2-[2-(3,4-diethoxyphenyl)acetyl]-3-[(3-methoxyphenyl)amino]-](/api/spectrum/7bRCZDYuP8/structure.png?h=300&w=458 "2-Cyclohexen-1-one, 2-[2-(3,4-diethoxyphenyl)acetyl]-3-[(3-methoxyphenyl)amino]-")
