| SpectraBase Spectrum ID |
DhhqZkEW8gz |
| Name |
Benzenemethanamine,3,4-dimethoxy-N-[1-(2,4-dihydroxyphenyl)-2-(4-chlorophenyl)ethylidene]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
411.123735888 u |
| Formula |
C23H22ClNO4 |
| InChI |
InChI=1S/C23H22ClNO4/c1-28-22-10-5-16(12-23(22)29-2)14-25-20(11-15-3-6-17(24)7-4-15)19-9-8-18(26)13-21(19)27/h3-10,12-13,26-27H,11,14H2,1-2H3/b25-20+ |
| InChIKey |
QGWWSCJDZWWLOL-LKUDQCMESA-N |
| Molecular Weight |
411.885 g/mol |
| SMILES |
C1(O)=CC(O)=C(C=C1)\C(=N\CC1=CC=C(OC)C(OC)=C1)CC1=CC=C(Cl)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.88491 |
![Benzenemethanamine,3,4-dimethoxy-N-[1-(2,4-dihydroxyphenyl)-2-(4-chlorophenyl)ethylidene]-](/api/spectrum/DhhqZkEW8gz/structure.png?h=300&w=458 "Benzenemethanamine,3,4-dimethoxy-N-[1-(2,4-dihydroxyphenyl)-2-(4-chlorophenyl)ethylidene]-")
