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Bromo-dodecahedrane
SpectraBase Compound ID ELf7lHAszDS
InChI InChI=1S/C20H19Br/c21-20-17-11-5-2-1-3-7(5)13(17)15-9(3)10-4(1)8-6(2)12(11)18(20)14(8)16(10)19(15)20/h1-19H
InChIKey AGWSVDQUESSJJJ-UHFFFAOYSA-N
Mol Weight 339.28 g/mol
Molecular Formula C20H19Br
Exact Mass 338.067014 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID VoDnjJ3KEr
Name Bromo-dodecahedrane
Comments CHEMICAL BONDS BETWEEN C1-C5 AND C1-C11 ARE NOT REPRESENTABLE
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Formula C20H19Br
InChI InChI=1S/C20H19Br/c21-20-17-11-5-2-1-3-7(5)13(17)15-9(3)10-4(1)8-6(2)12(11)18(20)14(8)16(10)19(15)20/h1-19H
InChIKey AGWSVDQUESSJJJ-UHFFFAOYSA-N
Instrument Name SF = 300 MHz
Literature Reference L.A. Paquette, J.C. Weber, T. Kobayashi, J. Am. Chem. Soc. 110, 8591 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3