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5-[(2-TERT.-BUTYLPHENYL)-METHYLIDEN]-2,6-DIMETHYL-3-HEPTYNE-2,6-DIOL
SpectraBase Compound ID 2MCQBh2yQKf
InChI InChI=1S/C20H28O2/c1-18(2,3)17-11-9-8-10-15(17)14-16(20(6,7)22)12-13-19(4,5)21/h8-11,14,21-22H,1-7H3/b16-14+
InChIKey IBIXEYZDODKMJA-JQIJEIRASA-N
Mol Weight 300.44 g/mol
Molecular Formula C20H28O2
Exact Mass 300.20893 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5309vn9MBxY
Name 5-[(2-TERT.-BUTYLPHENYL)-METHYLIDEN]-2,6-DIMETHYL-3-HEPTYNE-2,6-DIOL
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28O2
InChI InChI=1S/C20H28O2/c1-18(2,3)17-11-9-8-10-15(17)14-16(20(6,7)22)12-13-19(4,5)21/h8-11,14,21-22H,1-7H3/b16-14+
InChIKey IBIXEYZDODKMJA-JQIJEIRASA-N
Literature Reference Author J.J.GONZALEZ,A.FRANCESCH,D.J.CARDENAS,A.M.ECHAVARREN
Literature Reference Citation J.ORG.CHEM.,63,2854(1998)
Literature Reference DOI 10.1021/jo9717853
Molecular Weight 300.441 g/mol
Sample ID 37086
Solvent CDCl3