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3-allyl-2-[(2-phenylethyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
SpectraBase Compound ID IVmjGlnAEQy
InChI InChI=1S/C21H22N2OS2/c1-2-13-23-20(24)18-16-10-6-7-11-17(16)26-19(18)22-21(23)25-14-12-15-8-4-3-5-9-15/h2-5,8-9H,1,6-7,10-14H2
InChIKey KBTHUQAPRVINJW-UHFFFAOYSA-N
Mol Weight 382.54 g/mol
Molecular Formula C21H22N2OS2
Exact Mass 382.117356 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8GCkoyeaWzF
Name 3-allyl-2-[(2-phenylethyl)sulfanyl]-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/C21H22N2OS2/c1-2-13-23-20(24)18-16-10-6-7-11-17(16)26-19(18)22-21(23)25-14-12-15-8-4-3-5-9-15/h2-5,8-9H,1,6-7,10-14H2
InChIKey KBTHUQAPRVINJW-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_12238
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: 803544; Labnumber: BAD8-0208; VK_ID: VK-012243
Temperature 313 °C