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(+)-(S)-1-(4-BIPHENYL)-1-(4-BROMOBENZOYLOXY)-3-HEPTANONE

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(+)-(S)-1-(4-BIPHENYL)-1-(4-BROMOBENZOYLOXY)-3-HEPTANONE
SpectraBase Compound ID J2sFJDvb1cp
InChI InChI=1S/C26H25BrO3/c1-2-3-12-24(28)18-25(30-26(29)22-10-7-11-23(27)17-22)21-15-13-20(14-16-21)19-8-5-4-6-9-19/h4-11,13-17,25H,2-3,12,18H2,1H3/t25-/m0/s1
InChIKey LFAGAHTVEINSAS-VWLOTQADSA-N
Mol Weight 465.39 g/mol
Molecular Formula C26H25BrO3
Exact Mass 464.098708 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4GgaZzyKjFE
Name (+)-(S)-1-(4-BIPHENYL)-1-(4-BROMOBENZOYLOXY)-3-HEPTANONE
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H25BrO3
InChI InChI=1S/C26H25BrO3/c1-2-3-12-24(28)18-25(30-26(29)22-10-7-11-23(27)17-22)21-15-13-20(14-16-21)19-8-5-4-6-9-19/h4-11,13-17,25H,2-3,12,18H2,1H3/t25-/m0/s1
InChIKey LFAGAHTVEINSAS-VWLOTQADSA-N
Literature Reference Author S.E.DENMARK,R.A.STAVENGER,K.T.WONG
Literature Reference Citation J.ORG.CHEM.,63,918(1998)
Literature Reference DOI 10.1021/jo972168h
Molecular Weight 465.387 g/mol
Sample ID 33426
Solvent CDCl3