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2-bromoethynylbenzene
SpectraBase Compound ID 6j8ddiHiB71
InChI InChI=1S/C8H5Br/c9-7-6-8-4-2-1-3-5-8/h1-5H
InChIKey BPVHWNVBBDHIQU-UHFFFAOYSA-N
Mol Weight 181.03 g/mol
Molecular Formula C8H5Br
Exact Mass 179.957463 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D7oLmYp8Ti1
Name 1-Phenyl-2-bromo-acetylene
CAS Registry Number 932-87-6
Comments COUPLING CONSTANTS FROM 2ND REF. K.KAMIENSKA-TRELA,Z.BIEDRZYCKA,O
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H5Br
InChI InChI=1S/C8H5Br/c9-7-6-8-4-2-1-3-5-8/h1-5H
InChIKey BPVHWNVBBDHIQU-UHFFFAOYSA-N
Instrument Name Varian FT-80
Literature Reference D.J. Nelson, C.D. Blue, H.C.Brown, J. Am. Chem. Soc. 104, 4913 (1982).
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3