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N-[1-(1-adamantyl)-1H-pyrazol-3-yl]-5-(5-chloro-2-thienyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
SpectraBase Compound ID EpThqgyNg2K
InChI InChI=1S/C25H22ClF3N6OS/c26-20-2-1-18(37-20)16-8-19(25(27,28)29)35-22(30-16)9-17(32-35)23(36)31-21-3-4-34(33-21)24-10-13-5-14(11-24)7-15(6-13)12-24/h1-4,8-9,13-15H,5-7,10-12H2,(H,31,33,36)/t13-,14+,15-,24-
InChIKey AMBSVPICLQRTQD-UYJDEUBQSA-N
Mol Weight 547.0 g/mol
Molecular Formula C25H22ClF3N6OS
Exact Mass 546.121643 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2hRxelsaFk9
Name N-[1-(1-adamantyl)-1H-pyrazol-3-yl]-5-(5-chloro-2-thienyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-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/C25H22ClF3N6OS/c26-20-2-1-18(37-20)16-8-19(25(27,28)29)35-22(30-16)9-17(32-35)23(36)31-21-3-4-34(33-21)24-10-13-5-14(11-24)7-15(6-13)12-24/h1-4,8-9,13-15H,5-7,10-12H2,(H,31,33,36)/t13-,14+,15-,24-
InChIKey AMBSVPICLQRTQD-UYJDEUBQSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_6311
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/1024727; Labnumber: COL1310; UZI_ID: UZI-006313
Temperature 318 °C