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3-cyclohexyl-2-[(2-methyl-2-propenyl)sulfanyl]-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
SpectraBase Compound ID CZ229UBFt91
InChI InChI=1S/C21H28N2OS2/c1-14(2)13-25-21-22-19-18(16-11-7-4-8-12-17(16)26-19)20(24)23(21)15-9-5-3-6-10-15/h15H,1,3-13H2,2H3
InChIKey CVGNJTVLHSQIIJ-UHFFFAOYSA-N
Mol Weight 388.59 g/mol
Molecular Formula C21H28N2OS2
Exact Mass 388.164306 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5eQZrNj2pPI
Name 3-cyclohexyl-2-[(2-methyl-2-propenyl)sulfanyl]-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C21H28N2OS2/c1-14(2)13-25-21-22-19-18(16-11-7-4-8-12-17(16)26-19)20(24)23(21)15-9-5-3-6-10-15/h15H,1,3-13H2,2H3
InChIKey CVGNJTVLHSQIIJ-UHFFFAOYSA-N
NMR Offset 15.3548
NMR Spectrometer Frequency 300.133
Observed nucleus 1H
Origin 1H_UBI-VK_18310_12105
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent CDCl3
Source File Reference VendorID: 801151; Labnumber: AE95-691; VK_ID: VK-012110
Temperature 318 °C