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Pyridine, 3-(tert-butylthio)-4-phenyl-
SpectraBase Compound ID EhimMT7WzSd
InChI InChI=1S/C15H17NS/c1-15(2,3)17-14-11-16-10-9-13(14)12-7-5-4-6-8-12/h4-11H,1-3H3
InChIKey NQZOBJGIRUYUQQ-UHFFFAOYSA-N
Mol Weight 243.37 g/mol
Molecular Formula C15H17NS
Exact Mass 243.108171 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7dJuYXks6LW
Name Pyridine, 3-(tert-butylthio)-4-phenyl-
CAS Registry Number 18794-40-6
Comments Removed - unrepairable contamination (CDCl3)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17NS
InChI InChI=1S/C15H17NS/c1-15(2,3)17-14-11-16-10-9-13(14)12-7-5-4-6-8-12/h4-11H,1-3H3
InChIKey NQZOBJGIRUYUQQ-UHFFFAOYSA-N
Molecular Weight 243.368 g/mol
SMILES c1c(c(ccn1)-c1ccccc1)SC(C)(C)C
SPLASH splash10-001r-9100000000-3715463ba49b51776535
Source of Spectrum JX-2015-6-5558
Synonyms 3-t-butylmercapto-4-phenylpyridine 3-(tert-butylsulfanyl)-4-phenylpyridine 3-(tert-butylthio)-4-phenylpyridine Tert-butyl 4-phenyl-3-pyridinyl sulfide 3-Tert-butylsulfanyl-4-phenylpyridine 3-Tert-butylsulfanyl-4-phenyl-pyridine
Wiley ID 1729159