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3-chloro-N-[(1-methyl-1H-pyrazol-4-yl)methyl]-1-benzothiophene-2-carboxamide
SpectraBase Compound ID 4wzdc4RJPjb
InChI InChI=1S/C14H12ClN3OS/c1-18-8-9(7-17-18)6-16-14(19)13-12(15)10-4-2-3-5-11(10)20-13/h2-5,7-8H,6H2,1H3,(H,16,19)
InChIKey UDTIQSSSVGIMPB-UHFFFAOYSA-N
Mol Weight 305.78 g/mol
Molecular Formula C14H12ClN3OS
Exact Mass 305.038961 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LxaTqFKYQBJ
Name 3-chloro-N-[(1-methyl-1H-pyrazol-4-yl)methyl]-1-benzothiophene-2-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/C14H12ClN3OS/c1-18-8-9(7-17-18)6-16-14(19)13-12(15)10-4-2-3-5-11(10)20-13/h2-5,7-8H,6H2,1H3,(H,16,19)
InChIKey UDTIQSSSVGIMPB-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_1744
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: 9166628; UBI_ID: UBI-001745
Temperature 313 °C