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1-(1-adamantyl)-3-nitro-1H-1,2,4-triazole

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1-(1-adamantyl)-3-nitro-1H-1,2,4-triazole
SpectraBase Compound ID LAPRO3tTPyO
InChI InChI=1S/C12H16N4O2/c17-16(18)11-13-7-15(14-11)12-4-8-1-9(5-12)3-10(2-8)6-12/h7-10H,1-6H2/t8-,9+,10-,12-
InChIKey YDPOBHWXRSITLP-GOCCLTDMSA-N
Mol Weight 248.29 g/mol
Molecular Formula C12H16N4O2
Exact Mass 248.127326 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1h1rbrM9kyW
Name 1-(1-adamantyl)-3-nitro-1H-1,2,4-triazole
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/C12H16N4O2/c17-16(18)11-13-7-15(14-11)12-4-8-1-9(5-12)3-10(2-8)6-12/h7-10H,1-6H2/t8-,9+,10-,12-
InChIKey YDPOBHWXRSITLP-GOCCLTDMSA-N
NMR Offset 17.5285
NMR Spectrometer Frequency 500.138
Observed nucleus 1H
Origin 1H_UBI_21270_14657
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/1019900; UBI_ID: UBI-014660
Temperature 300 °C