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Methyl 1-{2-[(4-chlorophenyl)sulfinyl]ethyl}-2-oxo-12-vinylcyclododecanecarboxylate
SpectraBase Compound ID KOlfPBW0Sfp
InChI InChI=1S/C24H33ClO4S/c1-3-19-11-9-7-5-4-6-8-10-12-22(26)24(19,23(27)29-2)17-18-30(28)21-15-13-20(25)14-16-21/h3,13-16,19H,1,4-12,17-18H2,2H3
InChIKey ROVWYLDJXIDIQK-UHFFFAOYSA-N
Mol Weight 453.0 g/mol
Molecular Formula C24H33ClO4S
Exact Mass 452.178808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8vI0OEmdjB3
Name Methyl 1-{2-[(4-chlorophenyl)sulfinyl]ethyl}-2-oxo-12-vinylcyclododecanecarboxylate
Alternate Name(s) 2-Oxo-1-(2-(p-chlorophenylsulfinyl)ethyl)-12-vinyl-cyclododecancarboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H33ClO4S
InChI InChI=1S/C24H33ClO4S/c1-3-19-11-9-7-5-4-6-8-10-12-22(26)24(19,23(27)29-2)17-18-30(28)21-15-13-20(25)14-16-21/h3,13-16,19H,1,4-12,17-18H2,2H3
InChIKey ROVWYLDJXIDIQK-UHFFFAOYSA-N
Molecular Weight 453.037 g/mol
SMILES C1(C(=O)OC)(CCS(c2ccc(cc2)Cl)=O)C(=O)CCCCCCCCCC1C=C
SPLASH splash10-001l-5090100000-f2b9131af3a0ffe9587f
Source of Spectrum H-62-2650-0
Wiley ID 1388244