Pentoxazone

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Systematic / IUPAC Name: 3-[4-Chloro-5-(cyclopentyloxy)-2-fluorophenyl]-5-isopropylidene-1,3-oxazolidine-2,4-dione

ID: Reference2425

Other Names: (2-Fluoro-4-chloro-5-cyclopentyloxyphenyl)-5-isopropylidene-1,3-oxazolidine-2, 4-dione;
2,4-Oxazolidinedione, 3-[4-chloro-5-(cyclopentyloxy)-2-fluorophenyl]-5-(1-methylethylidene)-

Formula: C17H17ClFNO4

Class: Pesticides/Herbicides

Spectral Data

Pentoxazone 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 Plus Orbitrap
No. of Spectral Trees 1
No. of Spectra 45
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/11/2015 1:17:14 PM
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Identificators

InChI InChI=1S/C17H17ClFNO4/c1-9(2)15-16(21)20(17(22)24-15)13-8-14(11(18)7-12(13)19)23-10-5-3-4-6-10/h7-8,10H,3-6H2,1-2H3
InChI Key JZPKLLLUDLHCEL-UHFFFAOYSA-N
Canonical SMILES CC(=C1C(=O)N(C(=O)O1)C2=CC(=C(C=C2F)Cl)OC3CCCC3)C
CAS 110956757
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Other Names (2-Fluoro-4-chloro-5-cyclopentyloxyphenyl)-5-isopropylidene-1,3-oxazolidine-2, 4-dione;
2,4-Oxazolidinedione, 3-[4-chloro-5-(cyclopentyloxy)-2-fluorophenyl]-5-(1-methylethylidene)-

In Other Databases

ChEMBL CHEMBL2269481
PubChem 11714234
KEGG C18592
ChemSpider 9888955