| SpectraBase Spectrum ID |
DgmSzNezFJ3 |
| Name |
Ethanamine, 2-[4-(4-chloro-1,2-diphenyl-1-buten-1-yl)phenoxy]-N,N-dimethyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
405.185942225 u |
| Formula |
C26H28ClNO |
| InChI |
InChI=1S/C26H28ClNO/c1-28(2)19-20-29-24-15-13-23(14-16-24)26(22-11-7-4-8-12-22)25(17-18-27)21-9-5-3-6-10-21/h3-16H,17-20H2,1-2H3/b26-25- |
| InChIKey |
XFCLJVABOIYOMF-QPLCGJKRSA-N |
| Molecular Weight |
405.969 g/mol |
| SMILES |
C(Cl)C\C(=C\(C1=CC=C(C=C1)OCCN(C)C)C1=CC=CC=C1)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.85272 |
![Ethanamine, 2-[4-(4-chloro-1,2-diphenyl-1-buten-1-yl)phenoxy]-N,N-dimethyl-](/api/spectrum/DgmSzNezFJ3/structure.png?h=300&w=458 "Ethanamine, 2-[4-(4-chloro-1,2-diphenyl-1-buten-1-yl)phenoxy]-N,N-dimethyl-")
