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11-Hydroxy-7,7-bis(methylsulfonyl)-9-hexadecenecarboxylic acid, 16-lactone

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11-Hydroxy-7,7-bis(methylsulfonyl)-9-hexadecenecarboxylic acid, 16-lactone
SpectraBase Compound ID HsTg9iSiYb3
InChI InChI=1S/C18H32O7S2/c1-26(21,22)18(27(2,23)24)13-7-3-6-12-17(20)25-15-8-4-5-10-16(19)11-9-14-18/h9,11,16,19H,3-8,10,12-15H2,1-2H3/b11-9+
InChIKey ZDQKWHKQHCVNRT-PKNBQFBNSA-N
Mol Weight 424.6 g/mol
Molecular Formula C18H32O7S2
Exact Mass 424.158946 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KPc0eGBlfkc
Name 11-Hydroxy-7,7-bis(methylsulfonyl)-9-hexadecenecarboxylic acid, 16-lactone
CAS Registry Number 86471-77-4
Comments reassigned
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H32O7S2
InChI InChI=1S/C18H32O7S2/c1-26(21,22)18(27(2,23)24)13-7-3-6-12-17(20)25-15-8-4-5-10-16(19)11-9-14-18/h9,11,16,19H,3-8,10,12-15H2,1-2H3/b11-9+
InChIKey ZDQKWHKQHCVNRT-PKNBQFBNSA-N
Literature Reference B.M. Trost, R.W. Warner, J. Am. Chem. Soc. 105, 5940 (1983).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3