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(S)-(Z)-1-(1-Acetoxy-pentyl)-2-pentyl-cyclododecene
SpectraBase Compound ID BcREhc6xFfj
InChI InChI=1S/C24H44O2/c1-4-6-14-17-22-18-15-12-10-8-9-11-13-16-19-23(22)24(20-7-5-2)26-21(3)25/h24H,4-20H2,1-3H3/b23-22+
InChIKey KUVZOOLTSBPCJI-GHVJWSGMSA-N
Mol Weight 364.6 g/mol
Molecular Formula C24H44O2
Exact Mass 364.334131 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EmGr2YMzKm6
Name (S)-(Z)-1-(1-Acetoxy-pentyl)-2-pentyl-cyclododecene
Comments SHIFTCORRECTION: +0.2 PPM, REASSIGNED A.H.
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C24H44O2
InChI InChI=1S/C24H44O2/c1-4-6-14-17-22-18-15-12-10-8-9-11-13-16-19-23(22)24(20-7-5-2)26-21(3)25/h24H,4-20H2,1-3H3/b23-22+
InChIKey KUVZOOLTSBPCJI-GHVJWSGMSA-N
Instrument Name IBM NR-80
Literature Reference J.A. Marshall, K.E. Flynn, J. Am. Chem. Soc. 106, 723 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3