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N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
SpectraBase Compound ID Fy9ZFuKlQFq
InChI InChI=1S/C18H21N5O3S/c1-22-15(13(8-19-22)23(25)26)16(24)21-17-20-14(9-27-17)18-5-10-2-11(6-18)4-12(3-10)7-18/h8-12H,2-7H2,1H3,(H,20,21,24)/t10-,11+,12-,18-
InChIKey NWSJNUFBYZXXKN-TTXAVTLXSA-N
Mol Weight 387.46 g/mol
Molecular Formula C18H21N5O3S
Exact Mass 387.136511 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9F6Gc07gmx4
Name N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-1-methyl-4-nitro-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/C18H21N5O3S/c1-22-15(13(8-19-22)23(25)26)16(24)21-17-20-14(9-27-17)18-5-10-2-11(6-18)4-12(3-10)7-18/h8-12H,2-7H2,1H3,(H,20,21,24)/t10-,11+,12-,18-
InChIKey NWSJNUFBYZXXKN-TTXAVTLXSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_18647
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/9112621; Labnumber: UGB-0008843; UZI_ID: UZI-018654
Temperature 318 °C