EPN

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Systematic / IUPAC Name: Ethoxy-(4-nitrophenoxy)-phenyl-sulfanylidene-λ5-phosphane

ID: Reference13607

Other Names: Ethyl p-nitrophenyl benzenethiophosphonate;
AA-2412

Formula: C14H14NO4PS

Class: Pesticides/Herbicides

Spectral Data

EPN 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 Orbitrap ID-X with ETD_Cal Gateshead
No. of Spectral Trees 1
No. of Spectra 629
Tandem Spectra MS1, MS2, MS3
Ionization Methods NSI
Analyzers FT
Last Modification 10/20/2025 8:08:06 AM
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Identificators

InChI InChI=1S/C14H14NO4PS/c1-2-18-20(21,14-6-4-3-5-7-14)19-13-10-8-12(9-11-13)15(16)17/h3-11H,2H2,1H3
InChI Key AIGRXSNSLVJMEA-UHFFFAOYSA-N
Canonical SMILES CCOP(=S)(Oc1ccc([N+](=O)[O-])cc1)c1ccccc1
CAS
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Other Names Ethyl p-nitrophenyl benzenethiophosphonate;
AA-2412

In Other Databases

ChEMBL CHEMBL3184641
KEGG C14434
ChEBI CHEBI:34733
ChemSpider 15571
PubChem 16421