4-Pentyl-3-(4-pyridyl)-4,5-dihydro-1H-1,2,4-triazole-5-thione

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

ID: Reference3926

Other Names: 4-Pentyl-5-(pyridin-4-yl)-4H-1,2,4-triazole-3-thiol

Formula: C12H16N4S

Spectral Data

4-Pentyl-3-(4-pyridyl)-4,5-dihydro-1H-1,2,4-triazole-5-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 2/18/2016 12:10:49 PM
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Identificators

InChI InChI=1S/C12H16N4S/c1-2-3-4-9-16-11(14-15-12(16)17)10-5-7-13-8-6-10/h5-8H,2-4,9H2,1H3,(H,15,17)
InChI Key VSQDOCBKCDZNFN-UHFFFAOYSA-N
Canonical SMILES
CAS
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Other Names 4-Pentyl-5-(pyridin-4-yl)-4H-1,2,4-triazole-3-thiol

In Other Databases

PubChem 2806946
ChemSpider 2085429