5-(4-Chlorophenyl)-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione

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Systematic / IUPAC Name: 5-(4-Chlorophenyl)-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione

ID: Reference3982

Other Names: 5-(4-Chlorophenyl)-4-phenyl-1,2,4-triazole-3-thiol;
5-(4-Chloro-phenyl)-4-phenyl-4H-;
5-(4-Chlorophenyl)-4-phenyl-4H-[1,2,4]triazole-3-thiol

Formula: C14H10ClN3S

Spectral Data

5-(4-Chlorophenyl)-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione 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 2
No. of Spectra 238
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/27/2016 7:43:45 AM
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Identificators

InChI InChI=1S/C14H10ClN3S/c15-11-8-6-10(7-9-11)13-16-17-14(19)18(13)12-4-2-1-3-5-12/h1-9H,(H,17,19)
InChI Key AJOJIGWGJWZBOB-UHFFFAOYSA-N
Canonical SMILES C1=CC=C(C=C1)N2C(=NNC2=S)C3=CC=C(C=C3)Cl
CAS
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Other Names 5-(4-Chlorophenyl)-4-phenyl-1,2,4-triazole-3-thiol;
5-(4-Chloro-phenyl)-4-phenyl-4H-;
5-(4-Chlorophenyl)-4-phenyl-4H-[1,2,4]triazole-3-thiol

In Other Databases

ChemSpider 643639
PubChem 736518