Simetryn

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Systematic / IUPAC Name: 2-N,4-N-Diethyl-6-methylsulfanyl-1,3,5-triazine-2,4-diamine

ID: Reference2241

Other Names: Cymetrin;
Simetryne;
Symetryne;
2,4-Bis(ethylamino)-6-methylthio-1,3,5-triazine;
2,4-Bis(ethylamino)-6-(methylthio)-S-triazine ; more

Formula: C8H15N5S

Class: Pesticides/Herbicides

Spectral Data

Simetryn 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 Plus Orbitrap
No. of Spectral Trees 1
No. of Spectra 45
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 8/6/2015 11:31:37 AM
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Identificators

InChI InChI=1S/C8H15N5S/c1-4-9-6-11-7(10-5-2)13-8(12-6)14-3/h4-5H2,1-3H3,(H2,9,10,11,12,13)
InChI Key MGLWZSOBALDPEK-UHFFFAOYSA-N
Canonical SMILES CCNC1=NC(=NC(=N1)SC)NCC
CAS 1014706
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Other Names Cymetrin;
Simetryne;
Symetryne;
2,4-Bis(ethylamino)-6-methylthio-1,3,5-triazine;
2,4-Bis(ethylamino)-6-(methylthio)-S-triazine;
2,4-Di(Ethylamino)-6-methylthio-1,3,5-triazine;
S-Triazine, 2,4-bis(ethylamino)-6-(methylthio)-;
2-Methylthio-4,6-bis(ethylamino)-S-triazine;
2,4-Bis(ethylamino)-6-methylmercapto-S-triazine;
2-Methylmercapto-4,6-bis(ethylamino)-S-triazine;
2-Methylthio-4,6-bis(monoethylamino)-2-triazine;
4,6-Bis(ethylamino)-2-methylthio-1,3,5-triazine;
N-2,N-4-Diethyl-6-methylthio-1,3,5-triazine-2,4-diamine;
2-(Methylthio)-4,6-bis(ethylamino)-S-triazine;
2-(Methylmercapto)-4,6-bis(ethylamino)-S-triazine;
2-Methylthio-4,6-bis(ethylamino)-1,3,5-triazine

In Other Databases

ChemSpider 13303
KEGG C14457
ChEMBL CHEMBL1888800
ChEBI CHEBI:34976
ChemIDPlus 001014706; 039442416
PubChem 13905