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4'-DECANOYLBENZO-27-CROWN-9

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4'-DECANOYLBENZO-27-CROWN-9
SpectraBase Compound ID E9lJRImuLQ3
InChI InChI=1S/C32H54O10/c1-2-3-4-5-6-7-8-9-30(33)29-10-11-31-32(28-29)42-27-25-40-23-21-38-19-17-36-15-13-34-12-14-35-16-18-37-20-22-39-24-26-41-31/h10-11,28H,2-9,12-27H2,1H3
InChIKey OLRMPDCCUKGKOV-UHFFFAOYSA-N
Mol Weight 598.8 g/mol
Molecular Formula C32H54O10
Exact Mass 598.371698 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2XgkdTjTf55
Name 4'-DECANOYLBENZO-27-CROWN-9
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H54O10
InChI InChI=1S/C32H54O10/c1-2-3-4-5-6-7-8-9-30(33)29-10-11-31-32(28-29)42-27-25-40-23-21-38-19-17-36-15-13-34-12-14-35-16-18-37-20-22-39-24-26-41-31/h10-11,28H,2-9,12-27H2,1H3
InChIKey OLRMPDCCUKGKOV-UHFFFAOYSA-N
Literature Reference Author T.B.STOLWIJK,E.J.R.SUDHOELTER,D.N.REINHOUDT
Literature Reference Citation J.AM.CHEM.SOC.,111,6321(1989)
Literature Reference DOI 10.1021/ja00198a050
Molecular Weight 598.775 g/mol
Solvent CDCl3
Source File Reference UWCS11714