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3-(Oct-1-ynyl)-4,5-dihydro-furan-2(3H)-one
SpectraBase Compound ID AYfMmlelJm8
InChI InChI=1S/C12H18O2/c1-2-3-4-5-6-7-8-11-9-10-14-12(11)13/h11H,2-6,9-10H2,1H3
InChIKey QUAWPWVLZDAIDD-UHFFFAOYSA-N
Mol Weight 194.27 g/mol
Molecular Formula C12H18O2
Exact Mass 194.13068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KYErKJWMOOW
Name 3-(Oct-1-ynyl)-4,5-dihydro-furan-2(3H)-one
CAS Registry Number 121721-24-2
Comments VARIAN XL 100 OR BRUKER MW 400 SPECTROMETER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-2-3-4-5-6-7-8-11-9-10-14-12(11)13/h11H,2-6,9-10H2,1H3
InChIKey QUAWPWVLZDAIDD-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference M.G. Moloney, J.T. Pinhey, E.G.Roche, J. Chem. Soc. Perkin I 333 (1989).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3