Azoxystrobin

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Systematic / IUPAC Name: Methyl (2E)-2-(2-{[6-(2-cyanophenoxy)-4-pyrimidinyl]oxy}phenyl)-3-methoxyacrylate

ID: Reference43

Other Names: Benzeneacetic acid, 2-((6-(2-cyanophenoxy)-4-pyrimidinyl)oxy)-α-(methoxymethylene)-, methyl ester, (E)-;
Methyl (2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyprop-2-enoate;
Methyl (E)-2-(2-(6-(2-cyanopheoxy)pyrimidin-4-yloxy)phenyl)-3-methoxypropenoate;
Amistar;
Bankit ; more

Formula: C22H17N3O5

Class: Pesticides/Herbicides

Spectral Data

Azoxystrobin 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; Orbitrap Elite; Orbitrap ID-X with ETD_Cal Gateshead ; Q Exactive Orbitrap
No. of Spectral Trees 7
No. of Spectra 3242
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6, MS7
Ionization Methods ESI; APCI; NSI
Analyzers FT
Last Modification 10/10/2016 11:11:09 AM
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Identificators

InChI InChI=1S/C22H17N3O5/c1-27-13-17(22(26)28-2)16-8-4-6-10-19(16)30-21-11-20(24-14-25-21)29-18-9-5-3-7-15(18)12-23/h3-11,13-14H,1-2H3/b17-13+
InChI Key WFDXOXNFNRHQEC-GHRIWEEISA-N
Canonical SMILES O=C(OC)\C(=C\OC)c3ccccc3Oc2ncnc(Oc1c(C#N)cccc1)c2
CAS 131860338
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Other Names Benzeneacetic acid, 2-((6-(2-cyanophenoxy)-4-pyrimidinyl)oxy)-α-(methoxymethylene)-, methyl ester, (E)-;
Methyl (2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyprop-2-enoate;
Methyl (E)-2-(2-(6-(2-cyanopheoxy)pyrimidin-4-yloxy)phenyl)-3-methoxypropenoate;
Amistar;
Bankit;
Heritage;
Quadris;
Tcmdc-125883;
Ici-A 5504;
Azoxystrobine X

In Other Databases

ChemIDPlus 131860338
ChemSpider 2298772
Wikipedia Azoxystrobin
ChEMBL CHEMBL230001
PubChem 3034285
ChEBI CHEBI:40909