Metsulfuron-methyl

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Systematic / IUPAC Name: Methyl 2-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate

ID: Reference1084

Other Names: Allie;
Ally 20DF;
Ally;
Brush-off;
Escort ; more

Formula: C14H15N5O6S

Class: Pesticides/Herbicides

Spectral Data

Metsulfuron-methyl 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 Plus Orbitrap
No. of Spectral Trees 3
No. of Spectra 135
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 10/14/2016 12:33:12 PM
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Identificators

InChI InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)
InChI Key RSMUVYRMZCOLBH-UHFFFAOYSA-N
Canonical SMILES CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC
CAS 74223646
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Other Names Allie;
Ally 20DF;
Ally;
Brush-off;
Escort;
Granstar;
Gropper;
N-[(4-Methoxy-6-methyl-1,3,5-triazin-2-yl)aminocarbonyl]-2-methoxycarbonylbenzenesulfonamide ;
2-[({[(4-Methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl}amino)sulfonyl]benzoic acid methyl ester ;
Benzoic acid, 2-[({[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl}amino)sulfonyl]-, methyl ester ;
Methyl 2-[3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)ureidosulphonyl]benzoate ;
Metsulfuron methyl ester

In Other Databases

ChemIDPlus 074223646
Wikipedia Metsulfuron-methyl
ChemSpider 47883
ChEBI CHEBI:39678
KEGG C10946
ChEMBL CHEMBL1229749
PubChem 52999