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2,4-D
SpectraBase Compound ID 1oUQXnFBh69
InChI InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)
InChIKey OVSKIKFHRZPJSS-UHFFFAOYSA-N
Mol Weight 221.04 g/mol
Molecular Formula C8H6Cl2O3
Exact Mass 219.969399 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8rAE7iGe0hy
Name 2,4-D
Source of Sample Sigma-Aldrich Cat. #31518
CAS Registry Number 94-75-7
Classification Pesticides: Plant growth regulators
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 219.969399450 u
Formula C8H6Cl2O3
InChI InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)
InChIKey OVSKIKFHRZPJSS-UHFFFAOYSA-N
Molecular Weight 221.039 g/mol
Number of Peaks 47
RI1 1742
SMILES OC(COc1c(cc(cc1)Cl)Cl)=O
SPLASH splash10-03di-2920000000-ec0797f64a2a2ce605fd
Sample Comments RI1: measured on SLB-5ms (Alkanes) RI2: measured on Equity-1 (Alkanes)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Acetic acid, 2-(2,4-dichlorophenoxy)-
Wiley ID LM_PEST_474