5-[(4-Methylbenzyl)thio]-4-phenyl-3H-1,2-dithiole-3-thione

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Systematic / IUPAC Name: 5-[(4-Methylphenyl)methylsulfanyl]-4-phenyldithiole-3-thione

ID: Reference8638

Other Names: 3H-1,2-Dithiole-3-thione, 5-[[(4-methylphenyl)methyl]thio]-4-phenyl-

Formula: C17H14S4

Spectral Data

5-[(4-Methylbenzyl)thio]-4-phenyl-3H-1,2-dithiole-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 1
No. of Spectra 109
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/6/2019 9:28:22 AM
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Identificators

InChI InChI=1S/C17H14S4/c1-12-7-9-13(10-8-12)11-19-17-15(16(18)20-21-17)14-5-3-2-4-6-14/h2-10H,11H2,1H3
InChI Key OUKCJDWWFQLSIW-UHFFFAOYSA-N
Canonical SMILES CC1=CC=C(C=C1)CSC2=C(C(=S)SS2)C3=CC=CC=C3
CAS
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Other Names 3H-1,2-Dithiole-3-thione, 5-[[(4-methylphenyl)methyl]thio]-4-phenyl-

In Other Databases

PubChem 285818
ChemSpider 251937