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Methyl nonactyl-nonactate
SpectraBase Compound ID AssDHPf7NCW
InChI InChI=1S/C21H36O7/c1-12(22)10-16-6-8-19(27-16)15(4)21(24)26-13(2)11-17-7-9-18(28-17)14(3)20(23)25-5/h12-19,22H,6-11H2,1-5H3
InChIKey AGMMQSSSWVGAOR-UHFFFAOYSA-N
Mol Weight 400.5 g/mol
Molecular Formula C21H36O7
Exact Mass 400.246103 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7SlZ2R63ks9
Name Methyl nonactyl-nonactate
CAS Registry Number 91111-19-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H36O7
InChI InChI=1S/C21H36O7/c1-12(22)10-16-6-8-19(27-16)15(4)21(24)26-13(2)11-17-7-9-18(28-17)14(3)20(23)25-5/h12-19,22H,6-11H2,1-5H3
InChIKey AGMMQSSSWVGAOR-UHFFFAOYSA-N
Literature Reference P.A. Bartlett, J.D. Meadows, E.Ottow, J. Am. Chem. Soc. 106, 5304 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported