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5-PHENYLADAMANTANOL;MIXTURE_OF_ISOMERS
SpectraBase Compound ID 5Upx9SeF3RY
InChI InChI=1S/2C16H20O/c2*17-15-12-6-11-7-13(15)10-16(8-11,9-12)14-4-2-1-3-5-14/h2*1-5,11-13,15,17H,6-10H2/t11-,12-,13+,15+,16-;11-,12-,13-,15-,16-/m.0/s1
InChIKey HGBXUAPPLZOYBI-RIWDULRESA-N
Mol Weight 456.67 g/mol
Molecular Formula C32H40O2
Exact Mass 456.302831 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hp2Jl918FzH
Name 5-PHENYLADAMANTANOL;MIXTURE_OF_ISOMERS
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H40O2
InChI InChI=1S/2C16H20O/c2*17-15-12-6-11-7-13(15)10-16(8-11,9-12)14-4-2-1-3-5-14/h2*1-5,11-13,15,17H,6-10H2/t11-,12-,13+,15+,16-;11-,12-,13-,15-,16-/m.0/s1
InChIKey HGBXUAPPLZOYBI-RIWDULRESA-N
Literature Reference Author I.H.SONG,W.J.LENOBLE
Literature Reference Citation J.ORG.CHEM.,59,58(1994)
Literature Reference DOI 10.1021/jo00080a012
Molecular Weight 456.668 g/mol
Solvent Unknown
Source File Reference UWMZ2082