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3,6-Dichloro-o-anisic acid
SpectraBase Compound ID ET0s8elPGqS
InChI InChI=1S/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)
InChIKey IWEDIXLBFLAXBO-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 LXMNV6sfIUi
Name Dicamba
Source of Sample Sigma-Aldrich Cat. #45430
CAS Registry Number 1918-00-9
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 219.969399450 u
Formula C8H6Cl2O3
InChI InChI=1S/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)
InChIKey IWEDIXLBFLAXBO-UHFFFAOYSA-N
Molecular Weight 221.039 g/mol
Number of Peaks 49
RI1 1718
SMILES OC(c1c(c(ccc1Cl)Cl)OC)=O
SPLASH splash10-00di-3930000000-c0cdcdbc8f9ced0fff34
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 Benzoic acid, 3,6-dichloro-2-methoxy-
Wiley ID LM_PEST_908