N4-[1-(4-Chlorophenyl)-1-methyl-1-oxo-λ6-sulfanylidene]-2,1,3-benzoxadiazole-4-sulfonamide

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Systematic / IUPAC Name: N-[(4-Chlorophenyl)-methyl-oxo-λ6-sulfanylidene]-2,1,3-benzoxadiazole-4-sulfonamide

ID: Reference6385

Other Names: 2,1,3-Benzoxadiazole-4-sulfonamide, N-[(4-chlorophenyl)methyloxidosulfanylidene]-

Formula: C13H10ClN3O4S2

Spectral Data

N4-[1-(4-Chlorophenyl)-1-methyl-1-oxo-λ6-sulfanylidene]-2,1,3-benzoxadiazole-4-sulfonamide 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
No. of Spectral Trees 1
No. of Spectra 149
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/28/2017 6:48:33 AM
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Identificators

InChI InChI=1S/C13H10ClN3O4S2/c1-22(18,10-7-5-9(14)6-8-10)17-23(19,20)12-4-2-3-11-13(12)16-21-15-11/h2-8H,1H3
InChI Key DEFQWRVNJPZCTG-UHFFFAOYSA-N
Canonical SMILES CS(=NS(=O)(=O)C1=CC=CC2=NON=C21)(=O)C3=CC=C(C=C3)Cl
CAS
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Other Names 2,1,3-Benzoxadiazole-4-sulfonamide, N-[(4-chlorophenyl)methyloxidosulfanylidene]-

In Other Databases

ChemSpider 2099750
PubChem 2821523