| SpectraBase Spectrum ID |
Dv2wco2IQqc |
| Name |
3-[(Benzhydryl-amino)-methyl]-penta-2,4-dienoic acid, ethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
321.172878983 u |
| Formula |
C21H23NO2 |
| InChI |
InChI=1S/C21H23NO2/c1-3-17(15-20(23)24-4-2)16-22-21(18-11-7-5-8-12-18)19-13-9-6-10-14-19/h3,5-15,21-22H,1,4,16H2,2H3/b17-15+ |
| InChIKey |
KWDDQIRYQZTXBX-BMRADRMJSA-N |
| Molecular Weight |
321.420 g/mol |
| SMILES |
C1=CC(C(NC\C(C=C)=C\C(=O)OCC)C2=CC=CC=C2)=CC=C1 |
![3-[(Benzhydryl-amino)-methyl]-penta-2,4-dienoic acid, ethyl ester](/api/spectrum/Dv2wco2IQqc/structure.png?h=300&w=458 "3-[(Benzhydryl-amino)-methyl]-penta-2,4-dienoic acid, ethyl ester")
