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N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]benzamide
SpectraBase Compound ID JI3er34HJEc
InChI InChI=1S/C26H29BrN4OS/c1-15-23(27)16(2)31(30-15)13-17-4-3-5-21(9-17)24(32)29-25-28-22(14-33-25)26-10-18-6-19(11-26)8-20(7-18)12-26/h3-5,9,14,18-20H,6-8,10-13H2,1-2H3,(H,28,29,32)/t18-,19+,20-,26-
InChIKey SRVZRMGEWDMZQZ-VTTXJZCFSA-N
Mol Weight 525.51 g/mol
Molecular Formula C26H29BrN4OS
Exact Mass 524.124546 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CvpeHOa6O8P
Name N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]benzamide
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/C26H29BrN4OS/c1-15-23(27)16(2)31(30-15)13-17-4-3-5-21(9-17)24(32)29-25-28-22(14-33-25)26-10-18-6-19(11-26)8-20(7-18)12-26/h3-5,9,14,18-20H,6-8,10-13H2,1-2H3,(H,28,29,32)/t18-,19+,20-,26-
InChIKey SRVZRMGEWDMZQZ-VTTXJZCFSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_10205
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/1266906; Labnumber: JVT5204; UZI_ID: UZI-010207
Temperature 318 °C