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3-(3-bromophenyl)-6,6-dimethyl-2-(propylsulfanyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
SpectraBase Compound ID AQwdurJfiRu
InChI InChI=1S/C20H21BrN2O2S2/c1-4-8-26-19-22-17-16(14-10-20(2,3)25-11-15(14)27-17)18(24)23(19)13-7-5-6-12(21)9-13/h5-7,9H,4,8,10-11H2,1-3H3
InChIKey GHCJYEXGZOWMAW-UHFFFAOYSA-N
Mol Weight 465.42 g/mol
Molecular Formula C20H21BrN2O2S2
Exact Mass 464.022783 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8whGYV5Vdsv
Name 3-(3-bromophenyl)-6,6-dimethyl-2-(propylsulfanyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 464.022783270 u
Formula C20H21BrN2O2S2
InChI InChI=1S/C20H21BrN2O2S2/c1-4-8-26-19-22-17-16(14-10-20(2,3)25-11-15(14)27-17)18(24)23(19)13-7-5-6-12(21)9-13/h5-7,9H,4,8,10-11H2,1-3H3
InChIKey GHCJYEXGZOWMAW-UHFFFAOYSA-N
Molecular Weight 465.424 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_2041
Solvent DMSO-d6
Source Vendor ID: NMR/12278810