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N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
SpectraBase Compound ID 9ybmKQ5qZd0
InChI InChI=1S/C16H15F3N4OS/c1-8-3-4-9-10(7-20)15(25-12(9)5-8)21-14(24)11-6-13(16(17,18)19)22-23(11)2/h6,8H,3-5H2,1-2H3,(H,21,24)
InChIKey YMQPCMIRSKAXQU-UHFFFAOYSA-N
Mol Weight 368.38 g/mol
Molecular Formula C16H15F3N4OS
Exact Mass 368.091867 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E7K4U22ZL3u
Name N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-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/C16H15F3N4OS/c1-8-3-4-9-10(7-20)15(25-12(9)5-8)21-14(24)11-6-13(16(17,18)19)22-23(11)2/h6,8H,3-5H2,1-2H3,(H,21,24)
InChIKey YMQPCMIRSKAXQU-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_16494
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/1029425; Labnumber: OLG0300; UZI_ID: UZI-016498
Temperature 308 °C