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2-(isopentylsulfanyl)-3-(2-phenylethyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
SpectraBase Compound ID Dedh262FhmL
InChI InChI=1S/C23H28N2OS2/c1-16(2)13-15-27-23-24-21-20(18-10-6-7-11-19(18)28-21)22(26)25(23)14-12-17-8-4-3-5-9-17/h3-5,8-9,16H,6-7,10-15H2,1-2H3
InChIKey XNAKRDYDNIPFLE-UHFFFAOYSA-N
Mol Weight 412.61 g/mol
Molecular Formula C23H28N2OS2
Exact Mass 412.164306 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7QJ5CKEtv4D
Name 2-(isopentylsulfanyl)-3-(2-phenylethyl)-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/C23H28N2OS2/c1-16(2)13-15-27-23-24-21-20(18-10-6-7-11-19(18)28-21)22(26)25(23)14-12-17-8-4-3-5-9-17/h3-5,8-9,16H,6-7,10-15H2,1-2H3
InChIKey XNAKRDYDNIPFLE-UHFFFAOYSA-N
NMR Offset 15.3548
NMR Spectrometer Frequency 300.133
Observed nucleus 1H
Origin 1H_UBI-VK_18310_12123
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: 801135; Labnumber: AE95-667; VK_ID: VK-012128
Temperature 318 °C