| SpectraBase Spectrum ID |
6sqU2eCNnl9 |
| Name |
2-[(p-Chlorophenoxy)methyl]-1-methyl-3-methylene-2-indolinol, m-chlorobenzoate (ester) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
439.074198873 u |
| Formula |
C24H19Cl2NO3 |
| InChI |
InChI=1S/C24H19Cl2NO3/c1-16-21-8-3-4-9-22(21)27(2)24(16,15-29-20-12-10-18(25)11-13-20)30-23(28)17-6-5-7-19(26)14-17/h3-14H,1,15H2,2H3 |
| InChIKey |
JBORMNBMSSZGCP-UHFFFAOYSA-N |
| Molecular Weight |
440.326 g/mol |
| SMILES |
C=1(Cl)C=C(C(OC2(N(C3=C(C=CC=C3)C2=C)C)COC=2C=CC(=CC2)Cl)=O)C=CC1 |
| Spectrum/Structure Validation Score (Raman) |
0.909949 |
![2-[(p-Chlorophenoxy)methyl]-1-methyl-3-methylene-2-indolinol, m-chlorobenzoate (ester)](/api/spectrum/6sqU2eCNnl9/structure.png?h=300&w=458 "2-[(p-Chlorophenoxy)methyl]-1-methyl-3-methylene-2-indolinol, m-chlorobenzoate (ester)")
