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ethyl {[4-oxo-3-(2-phenylethyl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
SpectraBase Compound ID IqgxkR1wWd7
InChI InChI=1S/C22H24N2O3S2/c1-2-27-18(25)14-28-22-23-20-19(16-10-6-7-11-17(16)29-20)21(26)24(22)13-12-15-8-4-3-5-9-15/h3-5,8-9H,2,6-7,10-14H2,1H3
InChIKey MLXVPAMUWXUFST-UHFFFAOYSA-N
Mol Weight 428.57 g/mol
Molecular Formula C22H24N2O3S2
Exact Mass 428.122835 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4d7r0FqxVm6
Name ethyl {[4-oxo-3-(2-phenylethyl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
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/C22H24N2O3S2/c1-2-27-18(25)14-28-22-23-20-19(16-10-6-7-11-17(16)29-20)21(26)24(22)13-12-15-8-4-3-5-9-15/h3-5,8-9H,2,6-7,10-14H2,1H3
InChIKey MLXVPAMUWXUFST-UHFFFAOYSA-N
NMR Offset 15.3548
NMR Spectrometer Frequency 300.133
Observed nucleus 1H
Origin 1H_UBI-VK_18310_12126
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: 801142; Labnumber: AE95-679; VK_ID: VK-012131
Temperature 318 °C