Oxycarboxin

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Systematic / IUPAC Name: 2-Methyl-N-phenyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4,4-dioxide

ID: Reference2465

Other Names: Oxycarboxine;
Oxicarboxin;
Plantvax;
Dcmod;
Carboxin sulfone ; more

Formula: C12H13NO4S

Class: Pesticides/Herbicides

Spectral Data

Oxycarboxin 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 ; Q Exactive Plus Orbitrap
No. of Spectral Trees 3
No. of Spectra 2485
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods ESI; NSI
Analyzers FT
Last Modification 8/4/2015 2:52:07 PM
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Identificators

InChI InChI=1S/C12H13NO4S/c1-9-11(18(15,16)8-7-17-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)
InChI Key AMEKQAFGQBKLKX-UHFFFAOYSA-N
Canonical SMILES CC1=C(S(=O)(=O)CCO1)C(=O)NC2=CC=CC=C2
CAS 5259881
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Other Names Oxycarboxine;
Oxicarboxin;
Plantvax;
Dcmod;
Carboxin sulfone;
1,4-Oxathiin-3-carboxamide, 5,6-dihydro-2-methyl-N-phenyl, 4,4-dioxide;
5,6-Dihydro-2-methyl-N-phenyl-1,4-oxathiin-3-carboxamide 4,4-dioxide;
2,3-Dihydro-5-carboxanilido-6-methyl-1,4-oxathiin, 4,4-dioxide;
5,6-Dihydro-2-methyl-1,4-oxathiin-3-carboxanilide 4,4-dioxide;
2,3-Dihydro-6-methyl-5-phenylcarbamoyl-1,4-oxathiin 4,4-dioxide;
6-Methyl-4,4-dioxo-N-phenyl-2,3-dihydro-1,4-oxathiine-5-carboxamide;
Vitavex;
(6-Methyl-4,4-dioxo(2,3-dihydro-1,4-oxathiin-5-yl))-N-benzamide;
Dihydro-2-methyl-1,4-oxathiin-3-carboxanilide 4,4-dioxide;
5,6-Dihydro-2-methyl-3-carboxanilido-1,4-oxathiin-4,4-dioxid

In Other Databases

ChemSpider 20048
Wikipedia Oxycarboxin (DE)
ChEMBL CHEMBL1712057
KEGG C10956
ChEBI CHEBI:7858
PubChem 21330
ChemIDPlus 005259881