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propyl 2-({3-[(4-bromo-1H-pyrazol-1-yl)methyl]benzoyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID I6amvHM8fGY
InChI InChI=1S/C24H26BrN3O3S/c1-3-9-31-24(30)21-19-8-7-15(2)10-20(19)32-23(21)27-22(29)17-6-4-5-16(11-17)13-28-14-18(25)12-26-28/h4-6,11-12,14-15H,3,7-10,13H2,1-2H3,(H,27,29)
InChIKey OHRLVGQJXZUMMH-UHFFFAOYSA-N
Mol Weight 516.45 g/mol
Molecular Formula C24H26BrN3O3S
Exact Mass 515.087826 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LWuxZFVE0hN
Name propyl 2-({3-[(4-bromo-1H-pyrazol-1-yl)methyl]benzoyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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/C24H26BrN3O3S/c1-3-9-31-24(30)21-19-8-7-15(2)10-20(19)32-23(21)27-22(29)17-6-4-5-16(11-17)13-28-14-18(25)12-26-28/h4-6,11-12,14-15H,3,7-10,13H2,1-2H3,(H,27,29)
InChIKey OHRLVGQJXZUMMH-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_13258
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: UZI/9082429; UBI_ID: UBI-013261
Temperature 318 °C