Simetone

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

ID: Reference93

Other Names: Methoxy simazine;
2,4-Bis(ethylamino)-6-methoxy-s-triazine;
4,6-Bis(ethylamino)-2-methoxy-s-triazine;
s-Triazine, 2,4-bis(ethylamino)-6-methoxy-;
2-Methoxy-4,6-bis(ethylamino)-s-triazine ; more

Formula: C8H15N5O

Class: Pesticides/Herbicides

Spectral Data

Simetone 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 LTQ Orbitrap XL; Q Exactive Orbitrap
No. of Spectral Trees 2
No. of Spectra 78
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 11/4/2014 8:02:19 AM
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Identificators

InChI InChI=1S/C8H15N5O/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 HKAMKLBXTLTVCN-UHFFFAOYSA-N
Canonical SMILES CCNC1=NC(=NC(=N1)OC)NCC
CAS 673041
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Other Names Methoxy simazine;
2,4-Bis(ethylamino)-6-methoxy-s-triazine;
4,6-Bis(ethylamino)-2-methoxy-s-triazine;
s-Triazine, 2,4-bis(ethylamino)-6-methoxy-;
2-Methoxy-4,6-bis(ethylamino)-s-triazine;
2-Methoxy-4,6-bis(ethylamino)-1,3,5-triazine;
N,N'-Diethyl-6-methoxy-1,3,5-triazine-2,4-diamine;
Bis(ethylamino)-6-methoxy-s-triazine;
Methoxy-4,6-bis(ethylamino)-s-triazine;
Simeton;
Gesadural;
Pimeton;
Simatone

In Other Databases

PubChem 12654
ChemIDPlus 000673041
ChemSpider 12133
ChEBI CHEBI:30264