2,4-Dichlorophenoxyacetic acid

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Systematic / IUPAC Name: (2,4-Dichlorophenoxy)acetic acid

ID: Reference1550

Other Names: Acetic acid, 2-(2,4-dichlorophenoxy)-;
Hedonal;
Trinoxol

Formula: C8H6Cl2O3

Class: Pesticides/Herbicides

Spectral Data

2,4-Dichlorophenoxyacetic acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 3
No. of Spectra 214
Tandem Spectra MS1, MS2
Ionization Methods ESI; APCI
Analyzers FT
Last Modification 12/2/2014 1:46:43 PM
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Identificators

InChI InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)
InChI Key OVSKIKFHRZPJSS-UHFFFAOYSA-N
Canonical SMILES C1=CC(=C(C=C1Cl)Cl)OCC(=O)O
CAS 94757
Splash
Other Names Acetic acid, 2-(2,4-dichlorophenoxy)-;
Hedonal;
Trinoxol

In Other Databases

ChEBI CHEBI:28854
KEGG C03664
ChemIDPlus 000094757; 002307553; 008067558; 008068777; 008073618; 005742176; 073680689; 073680747; 093746340; 006365737
Wikipedia 2,4-Dichlorophenoxyacetic_acid
ChEMBL CHEMBL367623
ChemSpider 1441
PubChem 1486
HMDb HMDB41797