{3-[5-(2-Phenyleth-1-ynyl)-2-thienyl]-1H-pyrazol-1-yl}(2-thienyl)methanone

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Systematic / IUPAC Name: {3-[5-(Phenylethynyl)-2-thienyl]-1H-pyrazol-1-yl}(2-thienyl)methanone

ID: Reference6765

Other Names: Methanone, {3-[5-(2-phenylethynyl)-2-thienyl]-1H-pyrazol-1-yl}-2-thienyl-

Formula: C20H12N2OS2

Spectral Data

{3-[5-(2-Phenyleth-1-ynyl)-2-thienyl]-1H-pyrazol-1-yl}(2-thienyl)methanone 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 8/28/2017 9:53:06 AM
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Identificators

InChI InChI=1S/C20H12N2OS2/c23-20(19-7-4-14-24-19)22-13-12-17(21-22)18-11-10-16(25-18)9-8-15-5-2-1-3-6-15/h1-7,10-14H
InChI Key IYAHWROUDDDUHZ-UHFFFAOYSA-N
Canonical SMILES C1=CC=C(C=C1)C#CC2=CC=C(S2)C3=NN(C=C3)C(=O)C4=CC=CS4
CAS
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Other Names Methanone, {3-[5-(2-phenylethynyl)-2-thienyl]-1H-pyrazol-1-yl}-2-thienyl-

In Other Databases

PubChem 2822160
ChemSpider 2100376