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Methyl 1-(2-bromo-benzyl)-2-oxo-cyclohexane-1-carboxylate
SpectraBase Compound ID JAd7qsAyHjo
InChI InChI=1S/C15H17BrO3/c1-19-14(18)15(9-5-4-8-13(15)17)10-11-6-2-3-7-12(11)16/h2-3,6-7H,4-5,8-10H2,1H3
InChIKey JVSHMKRBRZZCPH-UHFFFAOYSA-N
Mol Weight 325.2 g/mol
Molecular Formula C15H17BrO3
Exact Mass 324.036107 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CoXsY4dqCV2
Name Methyl 1-(2-bromo-benzyl)-2-oxo-cyclohexane-1-carboxylate
CAS Registry Number 112211-71-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H17BrO3
InChI InChI=1S/C15H17BrO3/c1-19-14(18)15(9-5-4-8-13(15)17)10-11-6-2-3-7-12(11)16/h2-3,6-7H,4-5,8-10H2,1H3
InChIKey JVSHMKRBRZZCPH-UHFFFAOYSA-N
Instrument Name Varian XL-300
Literature Reference A.L. Beckwith, D.M. O'Shea, S.W. Westwood, J. Am. Chem. Soc. 110, 2565 (1988).
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3