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1-(4-BROMOPHENYL)-4-METHYL-1,3-PENTANEDIONE
SpectraBase Compound ID j5R42L8KA2
InChI InChI=1S/C12H13BrO2/c1-8(2)11(14)7-12(15)9-3-5-10(13)6-4-9/h3-8,15H,1-2H3/b12-7-
InChIKey XKOVPQMSBSLJJR-GHXNOFRVSA-N
Mol Weight 269.14 g/mol
Molecular Formula C12H13BrO2
Exact Mass 268.009893 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FWKOHboNoqP
Name 1-(4-BROMOPHENYL)-4-METHYL-1,3-PENTANEDIONE
CAS Registry Number 137919-76-7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13BrO2
InChI InChI=1S/C12H13BrO2/c1-8(2)11(14)7-12(15)9-3-5-10(13)6-4-9/h3-8,15H,1-2H3/b12-7-
InChIKey XKOVPQMSBSLJJR-GHXNOFRVSA-N
Literature Reference Author D.ENDERS,V.N.PATHAK,P.WEUSTER
Literature Reference Citation CHEM.BER.,125,515(1992)
Literature Reference DOI 10.1002/cber.19921250232
Molecular Weight 269.138 g/mol
Solvent CDCl3
Source File Reference UWCS8798