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3-pyridinecarbonitrile, 4-(4-methoxyphenyl)-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-6-phenyl-
SpectraBase Compound ID E6hNu3mI7pL
InChI InChI=1S/C26H25N3O2S/c1-31-21-12-10-19(11-13-21)22-16-24(20-8-4-2-5-9-20)28-26(23(22)17-27)32-18-25(30)29-14-6-3-7-15-29/h2,4-5,8-13,16H,3,6-7,14-15,18H2,1H3
InChIKey QXLLARCPQOCPND-UHFFFAOYSA-N
Mol Weight 443.57 g/mol
Molecular Formula C26H25N3O2S
Exact Mass 443.166748 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6IAirZJdmlc
Name 3-pyridinecarbonitrile, 4-(4-methoxyphenyl)-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-6-phenyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 443.166748229 u
Formula C26H25N3O2S
InChI InChI=1S/C26H25N3O2S/c1-31-21-12-10-19(11-13-21)22-16-24(20-8-4-2-5-9-20)28-26(23(22)17-27)32-18-25(30)29-14-6-3-7-15-29/h2,4-5,8-13,16H,3,6-7,14-15,18H2,1H3
InChIKey QXLLARCPQOCPND-UHFFFAOYSA-N
Molecular Weight 443.565 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5375
Solvent DMSO-d6
Source Vendor ID: NMR/9296400; Lab Info: NKS; Lab Number: NKS-aca0076