2-(1,3-Benzothiazol-2-yl)-3-(4-chlorophenyl)acrylonitrile

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Systematic / IUPAC Name: (2E)-2-(1,3-Benzothiazol-2-yl)-3-(4-chlorophenyl)acrylonitrile

ID: Reference4786

Other Names: (E)-2-(1,3-Benzothiazol-2-yl)-3-(4-chlorophenyl)prop-2-enenitrile;
(2E)-2-(1,3-Benzothiazol-2-yl)-3-(4-chlorophenyl)prop-2-enenitrile;
2-Benzothiazol-2-yl-3-(4-chloro-phenyl)-acrylonitrile

Formula: C16H9ClN2S

Spectral Data

2-(1,3-Benzothiazol-2-yl)-3-(4-chlorophenyl)acrylonitrile 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 119
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 5/11/2016 10:40:20 AM
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Identificators

InChI InChI=1S/C16H9ClN2S/c17-13-7-5-11(6-8-13)9-12(10-18)16-19-14-3-1-2-4-15(14)20-16/h1-9H/b12-9+
InChI Key USFXVNGXQXIMII-FMIVXFBMSA-N
Canonical SMILES C1=CC=C2C(=C1)N=C(S2)C(=CC3=CC=C(C=C3)Cl)C#N
CAS
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Other Names (E)-2-(1,3-Benzothiazol-2-yl)-3-(4-chlorophenyl)prop-2-enenitrile;
(2E)-2-(1,3-Benzothiazol-2-yl)-3-(4-chlorophenyl)prop-2-enenitrile;
2-Benzothiazol-2-yl-3-(4-chloro-phenyl)-acrylonitrile

In Other Databases

ChemSpider 4649186
PubChem 5710975