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2-Bromo-2-hexyl-3-oxo-decanoic acid, methyl ester
SpectraBase Compound ID HyEgg8Cctup
InChI InChI=1S/C17H31BrO3/c1-4-6-8-10-11-13-15(19)17(18,16(20)21-3)14-12-9-7-5-2/h4-14H2,1-3H3
InChIKey ZSJVILLIIYCSKR-UHFFFAOYSA-N
Mol Weight 363.34 g/mol
Molecular Formula C17H31BrO3
Exact Mass 362.145658 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AglwY5fqC3u
Name 2-Bromo-2-hexyl-3-oxo-decanoic acid, methyl ester
Comments HEN-C714
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Formula C17H31BrO3
InChI InChI=1S/C17H31BrO3/c1-4-6-8-10-11-13-15(19)17(18,16(20)21-3)14-12-9-7-5-2/h4-14H2,1-3H3
InChIKey ZSJVILLIIYCSKR-UHFFFAOYSA-N
Instrument Name Varian CFT-20
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3