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7-tert-butyl-2-(heptylsulfanyl)-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
SpectraBase Compound ID KFbEjB6wAK8
InChI InChI=1S/C27H36N2OS2/c1-5-6-7-8-12-17-31-26-28-24-23(25(30)29(26)20-13-10-9-11-14-20)21-16-15-19(27(2,3)4)18-22(21)32-24/h9-11,13-14,19H,5-8,12,15-18H2,1-4H3
InChIKey HLTJMLBPNHTSJX-UHFFFAOYSA-N
Mol Weight 468.7 g/mol
Molecular Formula C27H36N2OS2
Exact Mass 468.226906 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID K3PBaRhj4xN
Name 7-tert-butyl-2-(heptylsulfanyl)-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-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/C27H36N2OS2/c1-5-6-7-8-12-17-31-26-28-24-23(25(30)29(26)20-13-10-9-11-14-20)21-16-15-19(27(2,3)4)18-22(21)32-24/h9-11,13-14,19H,5-8,12,15-18H2,1-4H3
InChIKey HLTJMLBPNHTSJX-UHFFFAOYSA-N
NMR Offset 15.3548
NMR Spectrometer Frequency 300.133
Observed nucleus 1H
Origin 1H_UBI-VK_18310_12117
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 801118; Labnumber: AE95-624; VK_ID: VK-012122
Temperature 318 °C