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N-{1-methyl-2-[3-(trifluoromethyl)-1H-pyrazol-1-yl]ethyl}-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
SpectraBase Compound ID ExFa0SDbIqp
InChI InChI=1S/C16H18F3N3OS/c1-10(9-22-7-6-14(21-22)16(17,18)19)20-15(23)13-8-11-4-2-3-5-12(11)24-13/h6-8,10H,2-5,9H2,1H3,(H,20,23)
InChIKey JVMHIELKPXFIJK-UHFFFAOYSA-N
Mol Weight 357.4 g/mol
Molecular Formula C16H18F3N3OS
Exact Mass 357.112268 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6gHQ2qLcnSY
Name N-{1-methyl-2-[3-(trifluoromethyl)-1H-pyrazol-1-yl]ethyl}-4,5,6,7-tetrahydro-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/C16H18F3N3OS/c1-10(9-22-7-6-14(21-22)16(17,18)19)20-15(23)13-8-11-4-2-3-5-12(11)24-13/h6-8,10H,2-5,9H2,1H3,(H,20,23)
InChIKey JVMHIELKPXFIJK-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_33849
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: 1996644; SBI_ID: SBI-033853
Temperature 318 °C