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3-pyridinecarbonitrile, 4-(4-methoxyphenyl)-2-[[2-(4-morpholinyl)-2-oxoethyl]thio]-6-phenyl-
SpectraBase Compound ID 6kAhUKVWtpr
InChI InChI=1S/C25H23N3O3S/c1-30-20-9-7-18(8-10-20)21-15-23(19-5-3-2-4-6-19)27-25(22(21)16-26)32-17-24(29)28-11-13-31-14-12-28/h2-10,15H,11-14,17H2,1H3
InChIKey LWMZPVQVYHUQOI-UHFFFAOYSA-N
Mol Weight 445.54 g/mol
Molecular Formula C25H23N3O3S
Exact Mass 445.146013 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Dxm7rrat4Gw
Name 3-pyridinecarbonitrile, 4-(4-methoxyphenyl)-2-[[2-(4-morpholinyl)-2-oxoethyl]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 445.146012784 u
Formula C25H23N3O3S
InChI InChI=1S/C25H23N3O3S/c1-30-20-9-7-18(8-10-20)21-15-23(19-5-3-2-4-6-19)27-25(22(21)16-26)32-17-24(29)28-11-13-31-14-12-28/h2-10,15H,11-14,17H2,1H3
InChIKey LWMZPVQVYHUQOI-UHFFFAOYSA-N
Molecular Weight 445.537 g/mol
NMR Offset 16.0087
NMR Spectrometer Frequency 500.133
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_4281
Solvent DMSO-d6
Source Vendor ID: ZI/9061894; Lab Info: NKS; Lab Number: NKS-0010063