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2-Benzylsulfanyl-5-chloro-4,6-dimethyl-nicotinonitrile
SpectraBase Compound ID 4STuEO36KPr
InChI InChI=1S/C15H13ClN2S/c1-10-13(8-17)15(18-11(2)14(10)16)19-9-12-6-4-3-5-7-12/h3-7H,9H2,1-2H3
InChIKey CPWQEEPJRQFRAY-UHFFFAOYSA-N
Mol Weight 288.8 g/mol
Molecular Formula C15H13ClN2S
Exact Mass 288.048797 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EI6GMshMPBi
Name 3-pyridinecarbonitrile, 5-chloro-4,6-dimethyl-2-[(phenylmethyl)thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 288.048797301 u
Formula C15H13ClN2S
InChI InChI=1S/C15H13ClN2S/c1-10-13(8-17)15(18-11(2)14(10)16)19-9-12-6-4-3-5-7-12/h3-7H,9H2,1-2H3
InChIKey CPWQEEPJRQFRAY-UHFFFAOYSA-N
Molecular Weight 288.796 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15823
Solvent DMSO-d6
Source Vendor ID: NMR/11231932; Lab Info: KE; Lab Number: KE-0104098