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6-methyl-2-({[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

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6-methyl-2-({[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
SpectraBase Compound ID ASUs5M99z2j
InChI InChI=1S/C17H19F3N4O2S/c1-8-3-4-10-11(5-8)27-16(14(10)15(21)26)22-13(25)7-24-9(2)6-12(23-24)17(18,19)20/h6,8H,3-5,7H2,1-2H3,(H2,21,26)(H,22,25)
InChIKey DALQXYWRKIVWNT-UHFFFAOYSA-N
Mol Weight 400.42 g/mol
Molecular Formula C17H19F3N4O2S
Exact Mass 400.118082 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID J1jpNTgNMqZ
Name 6-methyl-2-({[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}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/C17H19F3N4O2S/c1-8-3-4-10-11(5-8)27-16(14(10)15(21)26)22-13(25)7-24-9(2)6-12(23-24)17(18,19)20/h6,8H,3-5,7H2,1-2H3,(H2,21,26)(H,22,25)
InChIKey DALQXYWRKIVWNT-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_16297
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/8096033; UBI_ID: UBI-016300
Temperature 308 °C