| SpectraBase Spectrum ID |
Azxq2fhK4YE |
| Name |
Methyl (2Z)-3-{5-bromo-2-[(2,6-dichlorobenzyl)oxy]phenyl}-2-cyano-2-propenoate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
438.937761647 u |
| Formula |
C18H12BrCl2NO3 |
| InChI |
InChI=1S/C18H12BrCl2NO3/c1-24-18(23)12(9-22)7-11-8-13(19)5-6-17(11)25-10-14-15(20)3-2-4-16(14)21/h2-8H,10H2,1H3/b12-7- |
| InChIKey |
CAYNAJWTYITITQ-GHXNOFRVSA-N |
| Molecular Weight |
441.108 g/mol |
| SMILES |
C(\C(C#N)=C/C=1C(OCC2=C(Cl)C=CC=C2Cl)=CC=C(Br)C1)(=O)OC |
![methyl (2Z)-3-{5-bromo-2-[(2,6-dichlorobenzyl)oxy]phenyl}-2-cyano-2-propenoate](/api/spectrum/Azxq2fhK4YE/structure.png?h=300&w=458 "methyl (2Z)-3-{5-bromo-2-[(2,6-dichlorobenzyl)oxy]phenyl}-2-cyano-2-propenoate")
