SpectraBase Spectrum ID |
JowH2wz3TJq |
Name |
[2,3-Dichloro-4-[2'-(cyanomethyl)butyryl-phenoxy]-acetic acid |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C14H13Cl2NO4 |
InChI |
InChI=1S/C14H13Cl2NO4/c1-2-8(5-6-17)14(20)9-3-4-10(13(16)12(9)15)21-7-11(18)19/h3-4,8H,2,5,7H2,1H3,(H,18,19) |
InChIKey |
JGEDURVMLIJBMY-UHFFFAOYSA-N |
Molecular Weight |
330.167 g/mol |
SMILES |
OC(COc1ccc(c(c1Cl)Cl)C(=O)C(CC#N)CC)=O |
SPLASH |
splash10-0002-0090000000-10bf8fd6f244b1581d10 |
Source of Spectrum |
D8-324-985-4 |
Wiley ID |
1514259 |