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3-pyridinecarbonitrile, 5-chloro-4,6-dimethyl-2-[[(5-nitro-2-furanyl)methyl]thio]-
SpectraBase Compound ID 1aMMPgvS42u
InChI InChI=1S/C13H10ClN3O3S/c1-7-10(5-15)13(16-8(2)12(7)14)21-6-9-3-4-11(20-9)17(18)19/h3-4H,6H2,1-2H3
InChIKey TYKQFNANHRXIJE-UHFFFAOYSA-N
Mol Weight 323.75 g/mol
Molecular Formula C13H10ClN3O3S
Exact Mass 323.01314 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 59rkWQtHwvH
Name 3-pyridinecarbonitrile, 5-chloro-4,6-dimethyl-2-[[(5-nitro-2-furanyl)methyl]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 323.013140065 u
Formula C13H10ClN3O3S
InChI InChI=1S/C13H10ClN3O3S/c1-7-10(5-15)13(16-8(2)12(7)14)21-6-9-3-4-11(20-9)17(18)19/h3-4H,6H2,1-2H3
InChIKey TYKQFNANHRXIJE-UHFFFAOYSA-N
Molecular Weight 323.754 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14901
Solvent DMSO-d6
Source Vendor ID: NMR/11210541; Lab Info: KE; Lab Number: KE-0103053