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LCTBUAFKAFMZQT-SSOQLKFYSA-N
SpectraBase Compound ID 3qVU2cl3BUD
InChI InChI=1S/C17H25Br2ClO2/c1-10-8-12(22-11(2)21)14(18)15(3,4)17(10)7-6-16(5,19)13(20)9-17/h12-14H,1,6-9H2,2-5H3/t12-,13+,14-,16+,17-/m1/s1
InChIKey LCTBUAFKAFMZQT-SSOQLKFYSA-N
Mol Weight 456.65 g/mol
Molecular Formula C17H25Br2ClO2
Exact Mass 453.990984 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BgfHQt2NDxz
Name LCTBUAFKAFMZQT-SSOQLKFYSA-N
Compound Number (-)-4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H25Br2ClO2
InChI InChI=1S/C17H25Br2ClO2/c1-10-8-12(22-11(2)21)14(18)15(3,4)17(10)7-6-16(5,19)13(20)9-17/h12-14H,1,6-9H2,2-5H3/t12-,13+,14-,16+,17-/m1/s1
InChIKey LCTBUAFKAFMZQT-SSOQLKFYSA-N
Literature Reference Author G.GUELLA,G.CHIASERA,I.MANCINI,F.PIETRA
Literature Reference Citation HELV.CHIM.ACTA,74,774(1991)
Literature Reference DOI 10.1002/hlca.19910740411
Molecular Weight 456.645 g/mol
Solvent CDCl3
Source File Reference UWVP4769