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4-methyl-3-[(4-methyl-2-oxo-1-phenyl-6-sulfanylidene-1,2,5,6-tetrahydropyridin-3-yl)(4-nitrophenyl)methyl]-1-phenyl-6-sulfanylidene-1,2,5,6-tetrahydropyridin-2-one
SpectraBase Compound ID KSPuLvjYMHy
InChI InChI=1S/C27H19N5O6S2/c33-22-20(24(35)30(26(39)28-22)16-7-3-1-4-8-16)19(15-11-13-18(14-12-15)32(37)38)21-23(34)29-27(40)31(25(21)36)17-9-5-2-6-10-17/h1-14,19,33-34H,(H,28,39)(H,29,40)
InChIKey HGVPUOXKAJDMGG-UHFFFAOYSA-N
Mol Weight 573.6 g/mol
Molecular Formula C27H19N5O6S2
Exact Mass 573.077676 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3jfxD7rXPjW
Name 4-methyl-3-[(4-methyl-2-oxo-1-phenyl-6-sulfanylidene-1,2,5,6-tetrahydropyridin-3-yl)(4-nitrophenyl)methyl]-1-phenyl-6-sulfanylidene-1,2,5,6-tetrahydropyridin-2-one
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 573.077675694 u
Formula C27H19N5O6S2
InChI InChI=1S/C27H19N5O6S2/c33-22-20(24(35)30(26(39)28-22)16-7-3-1-4-8-16)19(15-11-13-18(14-12-15)32(37)38)21-23(34)29-27(40)31(25(21)36)17-9-5-2-6-10-17/h1-14,19,33-34H,(H,28,39)(H,29,40)
InChIKey HGVPUOXKAJDMGG-UHFFFAOYSA-N
Molecular Weight 573.598 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_6416
Solvent DMSO-d6
Source Vendor ID: NMR/9301113; Lab Info: LP; Lab Number: LP-1701093