Spirodiclofen

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Systematic / IUPAC Name: 3-(2,4-Dichlorophenyl)-2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl 2,2-dimethylbutanoate

ID: Reference2229

Other Names:

Formula: C21H24Cl2O4

Class: Pesticides/Herbicides

Spectral Data

Spirodiclofen 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 Q Exactive Orbitrap; Q Exactive Plus Orbitrap
No. of Spectral Trees 2
No. of Spectra 162
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/9/2015 1:45:20 PM
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Identificators

InChI InChI=1S/C21H24Cl2O4/c1-4-20(2,3)19(25)26-17-16(14-9-8-13(22)12-15(14)23)18(24)27-21(17)10-6-5-7-11-21/h8-9,12H,4-7,10-11H2,1-3H3
InChI Key DTDSAWVUFPGDMX-UHFFFAOYSA-N
Canonical SMILES CCC(C)(C)C(=O)OC1=C(C(=O)OC12CCCCC2)C3=C(C=C(C=C3)Cl)Cl
CAS 148477718
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Other Names

In Other Databases

Wikipedia Spirodiclofen (DE)
PubChem 177863
KEGG C18553
ChEMBL CHEMBL2227839
ChemSpider 154839
ChemIDPlus 148477718
ChEBI CHEBI:38639