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Butanoic acid, 4-(2,4-dichlorophenoxy)-, methyl ester
SpectraBase Compound ID DK4tdUUWO9E
InChI InChI=1S/C11H12Cl2O3/c1-15-11(14)3-2-6-16-10-5-4-8(12)7-9(10)13/h4-5,7H,2-3,6H2,1H3
InChIKey NKXSNMCGZZWMMW-UHFFFAOYSA-N
Mol Weight 263.12 g/mol
Molecular Formula C11H12Cl2O3
Exact Mass 262.01635 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8LnzPfVJb3j
Name 2,4-DB methyl ester
Source of Sample Sigma-Aldrich Cat. #31244
CAS Registry Number 18625-12-2
Classification Pesticides: Herbicides
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 262.016349643 u
Formula C11H12Cl2O3
InChI InChI=1S/C11H12Cl2O3/c1-15-11(14)3-2-6-16-10-5-4-8(12)7-9(10)13/h4-5,7H,2-3,6H2,1H3
InChIKey NKXSNMCGZZWMMW-UHFFFAOYSA-N
Molecular Weight 263.120 g/mol
Number of Peaks 47
RI1 1847
SMILES c1(ccc(c(c1)Cl)OCCCC(=O)OC)Cl
SPLASH splash10-0zfr-8900000000-a7af6ccab52d98ee78c6
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 Butanoic acid, 4-(2,4-dichlorophenoxy)-, methyl ester
Wiley ID LM_PEST_575