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CP2HF(ORTHO-C6H4ME)ME

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CP2HF(ORTHO-C6H4ME)ME
SpectraBase Compound ID 1PpyN426Hm4
InChI InChI=1S/C7H7.2C5H.CH3.Hf/c1-7-5-3-2-4-6-7;2*1-2-4-5-3-1;;/h2-5H,1H3;2*1H;1H3;
InChIKey KQPHQYZFIABVLK-UHFFFAOYSA-N
Mol Weight 406.79 g/mol
Molecular Formula C18H12Hf
Exact Mass 408.04046 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2z6ABVuSbqV
Name (5-ETA-C5H5)2HF(ORTHO-C6H4-ME)ME
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H12Hf
InChI InChI=1S/C7H7.2C5H.CH3.Hf/c1-7-5-3-2-4-6-7;2*1-2-4-5-3-1;;/h2-5H,1H3;2*1H;1H3;
InChIKey KQPHQYZFIABVLK-UHFFFAOYSA-N
Literature Reference Author A.D.SADOW,T.D.TILLEY
Literature Reference Citation J.AM.CHEM.SOC.,124,6814(2002)
Literature Reference DOI 10.1021/ja025940t
Molecular Weight 406.783 g/mol
Sample ID 49207
Solvent C6D6