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ethyl [(7-tert-butyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate
SpectraBase Compound ID 420PIXBoVXY
InChI InChI=1S/C18H24N2O3S2/c1-5-23-13(21)9-24-17-19-15(22)14-11-7-6-10(18(2,3)4)8-12(11)25-16(14)20-17/h10H,5-9H2,1-4H3,(H,19,20,22)
InChIKey MLQOXYSKVMLIMI-UHFFFAOYSA-N
Mol Weight 380.52 g/mol
Molecular Formula C18H24N2O3S2
Exact Mass 380.122835 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID stqBiQ73Oo
Name ethyl [(7-tert-butyl-4-oxo-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/C18H24N2O3S2/c1-5-23-13(21)9-24-17-19-15(22)14-11-7-6-10(18(2,3)4)8-12(11)25-16(14)20-17/h10H,5-9H2,1-4H3,(H,19,20,22)
InChIKey MLQOXYSKVMLIMI-UHFFFAOYSA-N
NMR Offset 15.3548
NMR Spectrometer Frequency 300.133
Observed nucleus 1H
Origin 1H_UBI-VK_18310_11938
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: 800755; Labnumber: AE95-429; VK_ID: VK-011943
Temperature 318 °C