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6,6,7,7-TETRACHLORO-1-OCTYLBENZOATE
SpectraBase Compound ID 6EYwNQpdplH
InChI InChI=1S/C15H18Cl4O2/c1-14(16,17)15(18,19)10-6-3-7-11-21-13(20)12-8-4-2-5-9-12/h2,4-5,8-9H,3,6-7,10-11H2,1H3
InChIKey ALPHDIOMGFHWTN-UHFFFAOYSA-N
Mol Weight 372.1 g/mol
Molecular Formula C15H18Cl4O2
Exact Mass 370.006091 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D9nFPhCY23L
Name 6,6,7,7-TETRACHLORO-1-OCTYLBENZOATE
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H18Cl4O2
InChI InChI=1S/C15H18Cl4O2/c1-14(16,17)15(18,19)10-6-3-7-11-21-13(20)12-8-4-2-5-9-12/h2,4-5,8-9H,3,6-7,10-11H2,1H3
InChIKey ALPHDIOMGFHWTN-UHFFFAOYSA-N
Literature Reference Author S.PAIK,S.CARMELI,J.CULLINGHAM,R.E.MOORE,G.M.L.PATTERSON,M.A. TIUS
Literature Reference Citation J.AM.CHEM.SOC.,116,8116(1994)
Literature Reference DOI 10.1021/ja00097a019
Molecular Weight 372.119 g/mol
Solvent ACETONE-D6
Source File Reference UWSI107