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TERT.-BUTYL-2-(2-BROMO-5-METHOXYBENZYL)-ACETOACETATE
SpectraBase Compound ID 3q9fl19lmbT
InChI InChI=1S/C16H21BrO4/c1-10(18)13(15(19)21-16(2,3)4)9-11-8-12(20-5)6-7-14(11)17/h6-8,13H,9H2,1-5H3
InChIKey IWKYYQCIJJMSLH-UHFFFAOYSA-N
Mol Weight 357.24 g/mol
Molecular Formula C16H21BrO4
Exact Mass 356.062322 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 94mKu9E7nJ1
Name TERT.-BUTYL-2-(2-BROMO-5-METHOXYBENZYL)-ACETOACETATE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H21BrO4
InChI InChI=1S/C16H21BrO4/c1-10(18)13(15(19)21-16(2,3)4)9-11-8-12(20-5)6-7-14(11)17/h6-8,13H,9H2,1-5H3
InChIKey IWKYYQCIJJMSLH-UHFFFAOYSA-N
Literature Reference Author N.AL-MAHARIK,L.ENGMAN,J.MALMSTROEM,C.H.SCHIESSER
Literature Reference Citation J.ORG.CHEM.,66,6286(2001)
Literature Reference DOI 10.1021/jo010274k
Molecular Weight 357.244 g/mol
Solvent CDCl3
Source File Reference UWVN24704