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7-tert-butyl-3-(4-methylphenyl)-2-thioxo-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one
SpectraBase Compound ID IVjQIRJZOYK
InChI InChI=1S/C21H24N2OS2/c1-12-5-8-14(9-6-12)23-19(24)17-15-10-7-13(21(2,3)4)11-16(15)26-18(17)22-20(23)25/h5-6,8-9,13H,7,10-11H2,1-4H3,(H,22,25)
InChIKey ZAIFGMLJNNCFBS-UHFFFAOYSA-N
Mol Weight 384.56 g/mol
Molecular Formula C21H24N2OS2
Exact Mass 384.133006 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5jNvR7Sidwn
Name 7-tert-butyl-3-(4-methylphenyl)-2-thioxo-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-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/C21H24N2OS2/c1-12-5-8-14(9-6-12)23-19(24)17-15-10-7-13(21(2,3)4)11-16(15)26-18(17)22-20(23)25/h5-6,8-9,13H,7,10-11H2,1-4H3,(H,22,25)
InChIKey ZAIFGMLJNNCFBS-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_1917
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent ACETONE-d6
Source File Reference VendorID: 800744AE95-414; Labnumber: 800744AE95-414; VK_ID: VK-001918
Temperature 318 °C