3-[(4-Chlorophenyl)thio]-6-nitro-2,3-dihydro-1H-1λ~6~-benzo[b]thiophene-1,1-dione

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Systematic / IUPAC Name: 3-(4-Chlorophenyl)sulfanyl-6-nitro-2,3-dihydro-1-benzothiophene 1,1-dioxide

ID: Reference8610

Other Names: Benzo[b]thiophene, 3-[(4-chlorophenyl)thio]-2,3-dihydro-6-nitro-, 1,1-dioxide

Formula: C14H10ClNO4S2

Spectral Data

3-[(4-Chlorophenyl)thio]-6-nitro-2,3-dihydro-1H-1λ~6~-benzo[b]thiophene-1,1-dione 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 110
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/5/2019 1:57:33 PM
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Identificators

InChI InChI=1S/C14H10ClNO4S2/c15-9-1-4-11(5-2-9)21-13-8-22(19,20)14-7-10(16(17)18)3-6-12(13)14/h1-7,13H,8H2
InChI Key QWRXSTSPNBVTHW-UHFFFAOYSA-N
Canonical SMILES C1C(C2=C(S1(=O)=O)C=C(C=C2)[N+](=O)[O-])SC3=CC=C(C=C3)Cl
CAS
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Other Names Benzo[b]thiophene, 3-[(4-chlorophenyl)thio]-2,3-dihydro-6-nitro-, 1,1-dioxide

In Other Databases

ChemSpider 2100434
PubChem 2822218