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3-pyridinecarbonitrile, 4-(4-chlorophenyl)-1,4,5,6-tetrahydro-2-[(1-naphthalenylmethyl)thio]-6-oxo-
SpectraBase Compound ID 5IcGN6d2pW0
InChI InChI=1S/C23H17ClN2OS/c24-18-10-8-16(9-11-18)20-12-22(27)26-23(21(20)13-25)28-14-17-6-3-5-15-4-1-2-7-19(15)17/h1-11,20H,12,14H2,(H,26,27)
InChIKey MJTAOIJZVUBZHA-UHFFFAOYSA-N
Mol Weight 404.92 g/mol
Molecular Formula C23H17ClN2OS
Exact Mass 404.075012 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LwyqTKuP4TS
Name 3-pyridinecarbonitrile, 4-(4-chlorophenyl)-1,4,5,6-tetrahydro-2-[(1-naphthalenylmethyl)thio]-6-oxo-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 404.075012048 u
Formula C23H17ClN2OS
InChI InChI=1S/C23H17ClN2OS/c24-18-10-8-16(9-11-18)20-12-22(27)26-23(21(20)13-25)28-14-17-6-3-5-15-4-1-2-7-19(15)17/h1-11,20H,12,14H2,(H,26,27)
InChIKey MJTAOIJZVUBZHA-UHFFFAOYSA-N
Molecular Weight 404.915 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8985
Solvent DMSO-d6
Source Vendor ID: NMR/9253169; Lab Info: KR; Lab Number: KR-0000021