Simazine

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Systematic / IUPAC Name: 6-chloro-N2,N4-diethyl-1,3,5-triazine-2,4-diamine

ID: Reference92

Other Names: 2,4-Bis(ethylamino)-6-chloro-s-triazine;
2-Chloro-4,6-bis(ethylamino)-s-triazine;
s-Triazine, 2-chloro-4,6-bis(ethylamino)-;
2-Chloro-4,6-bis(ethylamino)-1,3,5-triazine;
6-Chloro-N2,N4-diethyl-1,3,5-triazine-2,4-diamine ; more

Formula: C7H12ClN5

Class: Pesticides/Herbicides

Spectral Data

Simazine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments LTQ Orbitrap XL; Q Exactive Orbitrap; Q Exactive Plus Orbitrap
No. of Spectral Trees 4
No. of Spectra 318
Tandem Spectra MS1, MS2
Ionization Methods ESI; APCI
Analyzers FT
Last Modification 2/10/2015 2:06:29 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C7H12ClN5/c1-3-9-6-11-5(8)12-7(13-6)10-4-2/h3-4H2,1-2H3,(H2,9,10,11,12,13)
InChI Key ODCWYMIRDDJXKW-UHFFFAOYSA-N
Canonical SMILES CCNC1=NC(=NC(=N1)Cl)NCC
CAS 122349
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Other Names 2,4-Bis(ethylamino)-6-chloro-s-triazine;
2-Chloro-4,6-bis(ethylamino)-s-triazine;
s-Triazine, 2-chloro-4,6-bis(ethylamino)-;
2-Chloro-4,6-bis(ethylamino)-1,3,5-triazine;
6-Chloro-N2,N4-diethyl-1,3,5-triazine-2,4-diamine;
2,4-Bis(ethylamino)-6-chloro-1,3,5-triazine;
1-Chloro-3,5-bis(ethylamino)-2,4,6-triazine;
Chloro-4,6-bis( ethylamino)-s-triazine;
[4-Chloro-6-(ethylamino)(1,3,5-triazin-2-yl)]ethylamine;
6-Chloro-N,N'-diethyl-1,3,5-triazine-2,4-diamine;
Gesatop;
Princep;
Simanex;
Herbazin 50;
Aquazine;
Batazina;
Herbazin;
Symazine;
Tafazine;
Taphazine;
Amizine;
Bitemol;
Gesapun;
Herbex;
Herboxy;
Printop;
Radocon;
Radokor;
Simadex;
Zeapur;
Primatol S;
Aktinit S;
Hungazin DT;
Tafazine 50-W;
Gesaran;
Premazine;
Simazin;
Cekuzina-S;
Primatel;
Cat;
Cekusima;
Yrodazin;
Simatsin-neste;
Herbatoxol S;
Batazine FLO;
Herbex;
Tafazine;
Permazine;
Printrex;
Framed;
Cekusan gesatop;
Princep 4G;
Princep 4L;
Aquazine 90WDG;
Caliber 90;
Gesatop-50;
Princep 80W;
Sim-trol 4L;
Bitemol S-50;
Princep caliber 90;
Simazat;
Azotop

In Other Databases

ChEMBL CHEMBL1605837
KEGG C11172
ChemSpider 5027
ChemIDPlus 000122349; 053126753; 037287539; 063821863
ChEBI CHEBI:27496
PubChem 5216
Wikipedia Simazine