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benzo[4,5]thieno[3,2-d]pyrimidine-3-butanamide, 2-[[2-(4-bromophenyl)-2-oxoethyl]thio]-N-cyclopentyl-3,4-dihydro-4-oxo-
SpectraBase Compound ID A3bxLpHXufv
InChI InChI=1S/C27H26BrN3O3S2/c28-18-13-11-17(12-14-18)21(32)16-35-27-30-24-20-8-3-4-9-22(20)36-25(24)26(34)31(27)15-5-10-23(33)29-19-6-1-2-7-19/h3-4,8-9,11-14,19H,1-2,5-7,10,15-16H2,(H,29,33)
InChIKey FGKABMHKAHXWFO-UHFFFAOYSA-N
Mol Weight 584.55 g/mol
Molecular Formula C27H26BrN3O3S2
Exact Mass 583.059897 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Bdn0b3eUJ5j
Name benzo[4,5]thieno[3,2-d]pyrimidine-3-butanamide, 2-[[2-(4-bromophenyl)-2-oxoethyl]thio]-N-cyclopentyl-3,4-dihydro-4-oxo-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 583.059897054 u
Formula C27H26BrN3O3S2
InChI InChI=1S/C27H26BrN3O3S2/c28-18-13-11-17(12-14-18)21(32)16-35-27-30-24-20-8-3-4-9-22(20)36-25(24)26(34)31(27)15-5-10-23(33)29-19-6-1-2-7-19/h3-4,8-9,11-14,19H,1-2,5-7,10,15-16H2,(H,29,33)
InChIKey FGKABMHKAHXWFO-UHFFFAOYSA-N
Molecular Weight 584.547 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_5594
Solvent DMSO-d6
Source Vendor ID: NMR/13288996