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(2,2-dimethyl-3-methylsulfonyloxy-propyl) 4-(2-methyl-3-oxidanylidene-cyclohexyl)butanoate
SpectraBase Compound ID 7FQA5TcMcrT
InChI InChI=1S/C17H30O6S/c1-13-14(7-5-9-15(13)18)8-6-10-16(19)22-11-17(2,3)12-23-24(4,20)21/h13-14H,5-12H2,1-4H3
InChIKey VKERQGNZEJSCBX-UHFFFAOYSA-N
Mol Weight 362.48 g/mol
Molecular Formula C17H30O6S
Exact Mass 362.17631 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GPyQgoFOkZ
Name (2,2-dimethyl-3-methylsulfonyloxy-propyl) 4-(2-methyl-3-oxidanylidene-cyclohexyl)butanoate
Alternate Name(s) 2-Methylcyclohexan-1-on-3-ylbutanoic acid, 2,2-dimethyl-3-(methylsulfonyloxy)propyl ester (2,2-dimethyl-3-methylsulfonyloxy-propyl) 4-(2-methyl-3-oxo-cyclohexyl)butanoate 4-(2-Methyl-3-oxocyclohexyl)butanoic acid (2,2-dimethyl-3-methylsulfonyloxypropyl) ester 4-(3-keto-2-methyl-cyclohexyl)butyric acid (2,2-dimethyl-3-methylsulfonyloxy-propyl) ester
CAS Registry Number 90846-76-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H30O6S
InChI InChI=1S/C17H30O6S/c1-13-14(7-5-9-15(13)18)8-6-10-16(19)22-11-17(2,3)12-23-24(4,20)21/h13-14H,5-12H2,1-4H3
InChIKey VKERQGNZEJSCBX-UHFFFAOYSA-N
Molecular Weight 362.481 g/mol
SMILES C(OS(=O)(=O)C)C(COC(=O)CCCC1C(C(=O)CCC1)C)(C)C
SPLASH splash10-03di-7900000000-c4ecfd8ffbc2db1c1430
Source of Spectrum H-67-843-0
Wiley ID 1349402