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1,4-di(1-adamantyl)-3-methyl-5-nitro-1H-pyrazole

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1,4-di(1-adamantyl)-3-methyl-5-nitro-1H-pyrazole
SpectraBase Compound ID 2GagGyVTG3
InChI InChI=1S/C24H33N3O2/c1-14-21(23-8-15-2-16(9-23)4-17(3-15)10-23)22(27(28)29)26(25-14)24-11-18-5-19(12-24)7-20(6-18)13-24/h15-20H,2-13H2,1H3/t15-,16+,17-,18?,19?,20?,23-,24?
InChIKey XRLGRICJAZCQNN-QFYGIEIWSA-N
Mol Weight 395.5 g/mol
Molecular Formula C24H33N3O2
Exact Mass 395.257277 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7ddcWq9ZmIM
Name 1,4-di(1-adamantyl)-3-methyl-5-nitro-1H-pyrazole
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/C24H33N3O2/c1-14-21(23-8-15-2-16(9-23)4-17(3-15)10-23)22(27(28)29)26(25-14)24-11-18-5-19(12-24)7-20(6-18)13-24/h15-20H,2-13H2,1H3/t15-,16+,17-,18?,19?,20?,23-,24?
InChIKey XRLGRICJAZCQNN-QFYGIEIWSA-N
NMR Offset 17.5285
NMR Spectrometer Frequency 500.138
Observed nucleus 1H
Origin 1H_UBI_21270_14749
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/1020110; UBI_ID: UBI-014752
Temperature 300 °C