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PACIFENOL
SpectraBase Compound ID LAwhPtSWCRX
InChI InChI=1S/C15H21Br2ClO2/c1-11(2)14-7-9(16)12(3,18)8-10(14)20-15(11,17)6-5-13(14,4)19/h5-6,9-10,19H,7-8H2,1-4H3/t9-,10?,12-,13+,14-,15-/m1/s1
InChIKey WNGMEQXERFPHIP-KDWHQKGXSA-N
Mol Weight 428.59 g/mol
Molecular Formula C15H21Br2ClO2
Exact Mass 425.959684 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cn3v8PPCfEy
Name PACIFENOL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H21Br2ClO2
InChI InChI=1S/C15H21Br2ClO2/c1-11(2)14-7-9(16)12(3,18)8-10(14)20-15(11,17)6-5-13(14,4)19/h5-6,9-10,19H,7-8H2,1-4H3/t9-,10?,12-,13+,14-,15-/m1/s1
InChIKey WNGMEQXERFPHIP-KDWHQKGXSA-N
Literature Reference Author R.DENYS,J.C.COLL,B.F.BOWDEN
Literature Reference Citation AUSTR.J.CHEM.,46,933(1993)
Literature Reference DOI 10.1071/ch9930933
Molecular Weight 428.592 g/mol
Solvent CDCl3
Source File Reference UWSK2179