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1-METHYL-5-(1-ADAMANTYL)-PYRAZOLE

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1-METHYL-5-(1-ADAMANTYL)-PYRAZOLE
SpectraBase Compound ID ngJePNVfCl
InChI InChI=1S/2C14H20N2/c2*1-16-13(2-3-15-16)14-7-10-4-11(8-14)6-12(5-10)9-14/h2*2-3,10-12H,4-9H2,1H3/t2*10-,11+,12-,14-
InChIKey CWBOXNUFQGNYND-UMJXNDIFSA-N
Mol Weight 432.66 g/mol
Molecular Formula C28H40N4
Exact Mass 432.325297 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I5Cn0MUNf3u
Name 1-METHYL-5-(1-ADAMANTYL)-PYRAZOLE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H40N4
InChI InChI=1S/2C14H20N2/c2*1-16-13(2-3-15-16)14-7-10-4-11(8-14)6-12(5-10)9-14/h2*2-3,10-12H,4-9H2,1H3/t2*10-,11+,12-,14-
InChIKey CWBOXNUFQGNYND-UMJXNDIFSA-N
Literature Reference Author R.M.CLARAMUNT,M.D.S.MARIA,I.FORFAR,F.AGUILAR-PARILLA,M.MINGU ET-BONHEVI,O.KLEIN,H
Literature Reference Citation J.CHEM.SOC.PERKIN-2,1867(1997)
Literature Reference DOI 10.1039/a607436g
Molecular Weight 432.652 g/mol
Solvent SOLID-STATEC28H38N4
Source File Reference UWRU6299