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About This Item
Empirical Formula (Hill Notation):
C14H4N2O2S2
CAS Number:
Molecular Weight:
296.32
Beilstein:
1325563
EC Number:
MDL number:
UNSPSC Code:
41116107
PubChem Substance ID:
NACRES:
NA.24
Recommended Products
grade
analytical standard
Quality Level
product line
PESTANAL®
shelf life
limited shelf life, expiry date on the label
technique(s)
HPLC: suitable
gas chromatography (GC): suitable
application(s)
agriculture
environmental
format
neat
SMILES string
O=C1C2=C(SC(C#N)=C(S2)C#N)C(=O)c3ccccc13
InChI
1S/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H
InChI key
PYZSVQVRHDXQSL-UHFFFAOYSA-N
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General description
Dithianons belong to the quinone class of fungicides.
Application
Dithianon may be used as an analytical reference standard for the determination of dithianon in:
- Surface water samples by solid-phase extraction (SPE) and liquid chromatography coupled to quadrupole time-of-flight mass spectrometry (LC-Q-TOFMS).
- Honeybees by dispersive-SPE followed by liquid and gas chromatography coupled to tandem mass spectrometry (LC-MS/MS and GC-MS/MS) equipped with electrospray ionization (ESI) and multiple reaction monitoring (MRM) detection.
- Apples by quick, easy, cheap, effective, rugged and safe (QuEChERS) extraction as well as high performance thin-layer chromatography (HPTLC) clean-up procedures and GC-MS/MS.
- Tomatoes by QuEChERS extraction and LC coupled to triple quadrupole (QqQ) ESI-MS/MS with MRM detection.
Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.
Recommended products
Find a digital Reference Material for this product available on our online platform ChemisTwin® for NMR. You can use this digital equivalent on ChemisTwin® for your sample identity confirmation and compound quantification (with digital external standard). An NMR spectrum of this substance can be viewed and an online comparison against your sample can be performed with a few mouseclicks. Learn more here and start your free trial.
Legal Information
PESTANAL is a registered trademark of Merck KGaA, Darmstadt, Germany
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Acute Tox. 4 Oral - Aquatic Acute 1 - Aquatic Chronic 1
Storage Class Code
11 - Combustible Solids
WGK
WGK 3
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
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L Pozzetti et al.
Cancer letters, 141(1-2), 47-56 (1999-08-24)
With the aim of evaluating the co-carcinogenic properties of dithianon, the regio- and stereo-selective hydroxylation of testosterone was used as a multibiomarker of effect for cytochrome P450 (CYP) changes. CYP-catalysed reactions have been studied in liver, kidney and lung microsomes
Uwe Wanner et al.
Environmental pollution (Barking, Essex : 1987), 133(1), 63-70 (2004-08-26)
Degradation studies were conducted with the fungicide (14)C-dithianon under standard conditions for 64 days in soil. The compound is characterized by mineralization losses of approx. 33% and the formation of non-extractable (bound) residues of approx. 63% in 64 days. The
Automated online solid-phase extraction-liquid chromatography mass spectrometric analysis of dithianon in water.
Passoni A, et al.
Eur. J. Mass Spectrom., 22(5), 261-267 (2016)
Determination of residues of dithianon in apples by high-performance liquid chromatography.
P G Baker et al.
The Analyst, 109(1), 81-83 (1984-01-01)
Determination of 115 pesticide residues in oranges by high-performance liquid chromatography-triple-quadrupole mass spectrometry in combination with QuEChERS method.
Golge O and Kabak B
J. Food Compos. Anal., 41, 86-97 (2015)
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