| SpectraBase Spectrum ID |
BJGQMQZD8Kd |
| Name |
Propanoic acid, 2-[2-chloro-4-(4-chlorobenzoylamino)phenoxy]-, ethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
381.053463427 u |
| Formula |
C18H17Cl2NO4 |
| InChI |
InChI=1S/C18H17Cl2NO4/c1-3-24-18(23)11(2)25-16-9-8-14(10-15(16)20)21-17(22)12-4-6-13(19)7-5-12/h4-11H,3H2,1-2H3,(H,21,22) |
| InChIKey |
VRMCPAHIKADPDD-UHFFFAOYSA-N |
| Molecular Weight |
382.243 g/mol |
| SMILES |
C(NC=1C=C(C(OC(C(OCC)=O)C)=CC1)Cl)(C1=CC=C(C=C1)Cl)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.924535 |
![Propanoic acid, 2-[2-chloro-4-(4-chlorobenzoylamino)phenoxy]-, ethyl ester](/api/spectrum/BJGQMQZD8Kd/structure.png?h=300&w=458 "Propanoic acid, 2-[2-chloro-4-(4-chlorobenzoylamino)phenoxy]-, ethyl ester")
