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thieno[2,3-d]pyrimidine-6-carboxamide, 1-[(2-chloro-4-fluorophenyl)methyl]-N,N-diethyl-1,2,3,4-tetrahydro-5-methyl-2,4-dioxo-3-(2-
SpectraBase Compound ID 5UlKztK2odz
InChI InChI=1S/C27H27ClFN3O3S/c1-4-30(5-2)25(34)23-17(3)22-24(33)31(14-13-18-9-7-6-8-10-18)27(35)32(26(22)36-23)16-19-11-12-20(29)15-21(19)28/h6-12,15H,4-5,13-14,16H2,1-3H3
InChIKey CNJPDDHDTRYCTM-UHFFFAOYSA-N
Mol Weight 528.04 g/mol
Molecular Formula C27H27ClFN3O3S
Exact Mass 527.144569 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CEuXNA4wmAR
Name thieno[2,3-d]pyrimidine-6-carboxamide, 1-[(2-chloro-4-fluorophenyl)methyl]-N,N-diethyl-1,2,3,4-tetrahydro-5-methyl-2,4-dioxo-3-(2-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 527.144568775 u
Formula C27H27ClFN3O3S
InChI InChI=1S/C27H27ClFN3O3S/c1-4-30(5-2)25(34)23-17(3)22-24(33)31(14-13-18-9-7-6-8-10-18)27(35)32(26(22)36-23)16-19-11-12-20(29)15-21(19)28/h6-12,15H,4-5,13-14,16H2,1-3H3
InChIKey CNJPDDHDTRYCTM-UHFFFAOYSA-N
Molecular Weight 528.042 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_1504
Solvent DMSO-d6
Source Vendor ID: NMR/13248750