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3-(2-pyridin-4-ylethyl)-1,3-benzothiazole-2-thione
SpectraBase Compound ID 125UevnHG4O
InChI InChI=1S/C14H12N2S2/c17-14-16(10-7-11-5-8-15-9-6-11)12-3-1-2-4-13(12)18-14/h1-6,8-9H,7,10H2
InChIKey OHOOYTLUJZZAGI-UHFFFAOYSA-N
Mol Weight 272.38 g/mol
Molecular Formula C14H12N2S2
Exact Mass 272.044191 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EAgQGVGDtEj
Name 3-(2-pyridin-4-ylethyl)-1,3-benzothiazole-2-thione
CAS Registry Number 27410-87-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12N2S2
InChI InChI=1S/C14H12N2S2/c17-14-16(10-7-11-5-8-15-9-6-11)12-3-1-2-4-13(12)18-14/h1-6,8-9H,7,10H2
InChIKey OHOOYTLUJZZAGI-UHFFFAOYSA-N
Molecular Weight 272.384 g/mol
SMILES C1(N(c2ccccc2S1)CCc1ccncc1)=S
SPLASH splash10-066r-0930000000-8fdbc4633e8c60c0dc44
Source of Spectrum J-51-4919-21
Synonyms 3-[2-(4-pyridyl)ethyl]-1,3-benzothiazole-2-thione
Wiley ID 1275980