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N-{4-[(1-adamantylamino)sulfonyl]phenyl}-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
SpectraBase Compound ID Cl8GEE4Hy7M
InChI InChI=1S/C22H25F3N4O3S/c1-29-18(9-19(27-29)22(23,24)25)20(30)26-16-2-4-17(5-3-16)33(31,32)28-21-10-13-6-14(11-21)8-15(7-13)12-21/h2-5,9,13-15,28H,6-8,10-12H2,1H3,(H,26,30)/t13-,14+,15-,21-
InChIKey JJEVCXNQJMFFHO-FZUGUKJMSA-N
Mol Weight 482.52 g/mol
Molecular Formula C22H25F3N4O3S
Exact Mass 482.159946 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AeXz0qT22tJ
Name N-{4-[(1-adamantylamino)sulfonyl]phenyl}-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/C22H25F3N4O3S/c1-29-18(9-19(27-29)22(23,24)25)20(30)26-16-2-4-17(5-3-16)33(31,32)28-21-10-13-6-14(11-21)8-15(7-13)12-21/h2-5,9,13-15,28H,6-8,10-12H2,1H3,(H,26,30)/t13-,14+,15-,21-
InChIKey JJEVCXNQJMFFHO-FZUGUKJMSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_11342
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/9088310; UBI_ID: UBI-011345
Temperature 308 °C