Bentranil

Systematic / IUPAC Name: 2-Phenyl-4H-3,1-benzoxazin-4-one

ID: Reference1909

Other Names: Linarotox;
Linurotox;
2-Phenyl-3,1-benzoxazin-4-one;
4H-3,1-Benzoxazin-4-one, 2-phenyl-;
2-Phenyl-3,1-benzoxazinone-(4)

Formula: C14H9NO2

Class: Pesticides/Herbicides

Spectral Data

Bentranil 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 1/15/2015 3:10:35 PM
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Identificators

InChI InChI=1S/C14H9NO2/c16-14-11-8-4-5-9-12(11)15-13(17-14)10-6-2-1-3-7-10/h1-9H
InChI Key HTTLBYITFHMYFK-UHFFFAOYSA-N
Canonical SMILES C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=O)O2
CAS 1022464
Splash
Other Names Linarotox;
Linurotox;
2-Phenyl-3,1-benzoxazin-4-one;
4H-3,1-Benzoxazin-4-one, 2-phenyl-;
2-Phenyl-3,1-benzoxazinone-(4);
2-Phenylbenzo[d]1,3-oxazin-4-one

In Other Databases

PubChem 13926
ChEMBL CHEMBL24449
ChemIDPlus 001022464
ChemSpider 13324