Trinexapac-ethyl

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Systematic / IUPAC Name: Ethyl 4-[cyclopropyl(hydroxy)methylene]-3,5-dioxocyclohexanecarboxylate

ID: Reference101

Other Names: Cyclohexanecarboxylic acid, 4-(cyclopropylhydroxymethylene)-3,5-dioxo-, ethyl ester;
Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexanecarboxylate;
4-(Cyclopropyl-α-hydroxymethylene)-3,5-dioxocyclohexanecarboxylic acid ethyl ester;
Ethyl 4-(cyclopropyl(hydroxy)methylene)-3,5-dioxocyclohexanecarboxylate;
Nomow ; more

Formula: C13H16O5

Class: Pesticides/Herbicides

Spectral Data

Trinexapac-ethyl 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 ID-X with ETD_Cal Gateshead
No. of Spectral Trees 5
No. of Spectra 10177
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods ESI; NSI
Analyzers FT
Last Modification 11/4/2014 10:09:56 AM
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Identificators

InChI InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3
InChI Key RVKCCVTVZORVGD-UHFFFAOYSA-N
Canonical SMILES CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1
CAS 95266403
Splash
Other Names Cyclohexanecarboxylic acid, 4-(cyclopropylhydroxymethylene)-3,5-dioxo-, ethyl ester;
Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexanecarboxylate;
4-(Cyclopropyl-α-hydroxymethylene)-3,5-dioxocyclohexanecarboxylic acid ethyl ester;
Ethyl 4-(cyclopropyl(hydroxy)methylene)-3,5-dioxocyclohexanecarboxylate;
Nomow;
Vision;
Cimectacarb;
Moddus;
Primo

In Other Databases

PubChem 92421
KEGG C18541
ChemSpider 83439
ChemIDPlus 095266403
Wikipedia Trinexapac (DE)