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1-Octyne
SpectraBase Compound ID Il4WZmPx5N3
InChI InChI=1S/C8H14/c1-3-5-7-8-6-4-2/h1H,4-8H2,2H3
InChIKey UMIPWJGWASORKV-UHFFFAOYSA-N
Mol Weight 110.2 g/mol
Molecular Formula C8H14
Exact Mass 110.10955 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GuYhsSmWJ7I
Name 1-Octyne
CAS Registry Number 629-05-0
Comments SHIFTCORRECTION: +0.9 PPM (A.H.)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H14
InChI InChI=1S/C8H14/c1-3-5-7-8-6-4-2/h1H,4-8H2,2H3
InChIKey UMIPWJGWASORKV-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