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2-{[3-(4-bromo-1H-pyrazol-1-yl)propanoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
SpectraBase Compound ID 8JhdrkRAyMs
InChI InChI=1S/C15H17BrN4O2S/c16-9-7-18-20(8-9)6-5-12(21)19-15-13(14(17)22)10-3-1-2-4-11(10)23-15/h7-8H,1-6H2,(H2,17,22)(H,19,21)
InChIKey QKGZJRKIROELCX-UHFFFAOYSA-N
Mol Weight 397.29 g/mol
Molecular Formula C15H17BrN4O2S
Exact Mass 396.02556 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9RGslKK44IC
Name 2-{[3-(4-bromo-1H-pyrazol-1-yl)propanoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
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/C15H17BrN4O2S/c16-9-7-18-20(8-9)6-5-12(21)19-15-13(14(17)22)10-3-1-2-4-11(10)23-15/h7-8H,1-6H2,(H2,17,22)(H,19,21)
InChIKey QKGZJRKIROELCX-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_1016
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/1198261; Labnumber: AC-NHALL/0422939; UZI_ID: UZI-001018
Temperature 308 °C