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3-(4-bromophenyl)-2-[(2-methyl-2-propenyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
SpectraBase Compound ID G7WXlVAiFOo
InChI InChI=1S/C20H19BrN2OS2/c1-12(2)11-25-20-22-18-17(15-5-3-4-6-16(15)26-18)19(24)23(20)14-9-7-13(21)8-10-14/h7-10H,1,3-6,11H2,2H3
InChIKey CGKQLRYTNRKXKU-UHFFFAOYSA-N
Mol Weight 447.41 g/mol
Molecular Formula C20H19BrN2OS2
Exact Mass 446.012219 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GqNZ3qqia94
Name 3-(4-bromophenyl)-2-[(2-methyl-2-propenyl)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/C20H19BrN2OS2/c1-12(2)11-25-20-22-18-17(15-5-3-4-6-16(15)26-18)19(24)23(20)14-9-7-13(21)8-10-14/h7-10H,1,3-6,11H2,2H3
InChIKey CGKQLRYTNRKXKU-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_17358
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: D25636; Labnumber: GRES-04733; SBI_ID: SBI-017361
Temperature 306 °C