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1-(4-chlorobenzyl)-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
SpectraBase Compound ID JTMM9sKW0WT
InChI InChI=1S/C23H19ClN2O2S/c24-16-12-10-15(11-13-16)14-25-22-20(18-8-4-5-9-19(18)29-22)21(27)26(23(25)28)17-6-2-1-3-7-17/h1-3,6-7,10-13H,4-5,8-9,14H2
InChIKey LVOUTANYSHWRMX-UHFFFAOYSA-N
Mol Weight 422.93 g/mol
Molecular Formula C23H19ClN2O2S
Exact Mass 422.085577 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LG3COD0Icd3
Name 1-(4-chlorobenzyl)-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 422.085576732 u
Formula C23H19ClN2O2S
InChI InChI=1S/C23H19ClN2O2S/c24-16-12-10-15(11-13-16)14-25-22-20(18-8-4-5-9-19(18)29-22)21(27)26(23(25)28)17-6-2-1-3-7-17/h1-3,6-7,10-13H,4-5,8-9,14H2
InChIKey LVOUTANYSHWRMX-UHFFFAOYSA-N
Molecular Weight 422.930 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_8027
Solvent DMSO-d6
Source Vendor ID: NMR/13218998