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6-Bromo-1,3,5-cycloheptatriene-1-carboxylic acid, methyl ester

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6-Bromo-1,3,5-cycloheptatriene-1-carboxylic acid, methyl ester
SpectraBase Compound ID LcNzDeYs0UX
InChI InChI=1S/C9H9BrO2/c1-12-9(11)7-4-2-3-5-8(10)6-7/h2-5H,6H2,1H3
InChIKey TVDOFWVPNUNOPV-UHFFFAOYSA-N
Mol Weight 229.07 g/mol
Molecular Formula C9H9BrO2
Exact Mass 227.978593 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GUis4rmSHeF
Name 6-Bromo-1,3,5-cycloheptatriene-1-carboxylic acid, methyl ester
CAS Registry Number 103149-60-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H9BrO2
InChI InChI=1S/C9H9BrO2/c1-12-9(11)7-4-2-3-5-8(10)6-7/h2-5H,6H2,1H3
InChIKey TVDOFWVPNUNOPV-UHFFFAOYSA-N
Instrument Name Bruker WM-300
Literature Reference E. Vogel, T. Schieb, W.H. Schulz, Angew. Chem. 98, 729 (1986).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3