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1-Bromo-3,3-dimethyl-1-butyne
SpectraBase Compound ID 55p6lIOXZZD
InChI InChI=1S/C6H9Br/c1-6(2,3)4-5-7/h1-3H3
InChIKey XJKPPUAWBFQJNI-UHFFFAOYSA-N
Mol Weight 161.04 g/mol
Molecular Formula C6H9Br
Exact Mass 159.988763 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jz5FrapLcGJ
Name 1-Bromo-3,3-dimethyl-1-butyne
CAS Registry Number 13601-86-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H9Br
InChI InChI=1S/C6H9Br/c1-6(2,3)4-5-7/h1-3H3
InChIKey XJKPPUAWBFQJNI-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