For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-[(2-chlorobenzyl)thio]-4,5,6-trimethyl-nicotinonitrile
SpectraBase Compound ID BMrBpRZSNjL
InChI InChI=1S/C16H15ClN2S/c1-10-11(2)14(8-18)16(19-12(10)3)20-9-13-6-4-5-7-15(13)17/h4-7H,9H2,1-3H3
InChIKey XRZKTQGECISJLK-UHFFFAOYSA-N
Mol Weight 302.82 g/mol
Molecular Formula C16H15ClN2S
Exact Mass 302.064447 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID COc3fi24tj9
Name 2-[(2-chlorobenzyl)thio]-4,5,6-trimethyl-nicotinonitrile
Alternate Name(s) 2-[(2-chlorophenyl)methylsulfanyl]-4,5,6-trimethyl-pyridine-3-carbonitrile 2-[(2-chlorophenyl)methylthio]-4,5,6-trimethyl-3-pyridinecarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15ClN2S
InChI InChI=1S/C16H15ClN2S/c1-10-11(2)14(8-18)16(19-12(10)3)20-9-13-6-4-5-7-15(13)17/h4-7H,9H2,1-3H3
InChIKey XRZKTQGECISJLK-UHFFFAOYSA-N
Molecular Weight 302.823 g/mol
SMILES c1(c(nc(c(c1C)C)C)SCc1c(Cl)cccc1)C#N
SPLASH splash10-005i-8951000000-c130cb43d45021767854
Wiley ID 1451057