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Cyclododecanecarboxylic acid, 2-ethenyl-12-oxo-, methyl ester, (R*,S*)-
SpectraBase Compound ID BaSRKRMusl5
InChI InChI=1S/C24H33ClO5S/c1-3-19-11-9-7-5-4-6-8-10-12-22(26)24(19,23(27)30-2)17-18-31(28,29)21-15-13-20(25)14-16-21/h3,13-16,19H,1,4-12,17-18H2,2H3
InChIKey SDPAAIXJKXBWMC-UHFFFAOYSA-N
Mol Weight 469.0 g/mol
Molecular Formula C24H33ClO5S
Exact Mass 468.173723 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JD84OCT0myJ
Name Cyclododecanecarboxylic acid, 2-ethenyl-12-oxo-, methyl ester, (R*,S*)-
CAS Registry Number 73466-57-6
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H33ClO5S
InChI InChI=1S/C24H33ClO5S/c1-3-19-11-9-7-5-4-6-8-10-12-22(26)24(19,23(27)30-2)17-18-31(28,29)21-15-13-20(25)14-16-21/h3,13-16,19H,1,4-12,17-18H2,2H3
InChIKey SDPAAIXJKXBWMC-UHFFFAOYSA-N
Molecular Weight 469.036 g/mol
SMILES C1(C(=O)OC)(CCS(c2ccc(cc2)Cl)(=O)=O)C(=O)CCCCCCCCCC1C=C
SPLASH splash10-0a4l-9200000000-b45de658847def7839da
Source of Spectrum H-62-2650-0
Synonyms Methyl 1-{2-[(4-chlorophenyl)sulfonyl]ethyl}-2-oxo-12-vinylcyclododecanecarboxylate Methyl ester of 2-oxo-1-(2-(p-chlorophenylsulfonyl)ethyl)-12-vinyl-cyclododecancarboxylic acid
Wiley ID 1392366