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(+)-(R)-Methyl 3,5-Dimethoxy-6-[8-oxo-9-(p-tolylsulfinyl)nonyl] benzoate
SpectraBase Compound ID IqcEMnQpBkl
InChI InChI=1S/C26H34O6S/c1-19-12-14-22(15-13-19)33(29)18-20(27)10-8-6-5-7-9-11-23-24(26(28)32-4)16-21(30-2)17-25(23)31-3/h12-17H,5-11,18H2,1-4H3
InChIKey SVGXATMRSCYUHE-UHFFFAOYSA-N
Mol Weight 474.6 g/mol
Molecular Formula C26H34O6S
Exact Mass 474.20761 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Gr0wCD0zVn
Name (+)-(R)-Methyl 3,5-Dimethoxy-6-[8-oxo-9-(p-tolylsulfinyl)nonyl] benzoate
Alternate Name(s) Methyl 3,5-dimethoxy-2-{9-[(4-methylphenyl)sulfinyl]-8-oxononyl}benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H34O6S
InChI InChI=1S/C26H34O6S/c1-19-12-14-22(15-13-19)33(29)18-20(27)10-8-6-5-7-9-11-23-24(26(28)32-4)16-21(30-2)17-25(23)31-3/h12-17H,5-11,18H2,1-4H3
InChIKey SVGXATMRSCYUHE-UHFFFAOYSA-N
Molecular Weight 474.612 g/mol
SMILES c1(c(c(OC)cc(c1)OC)CCCCCCCC(C[S@](c1ccc(cc1)C)=O)=O)C(=O)OC
SPLASH splash10-0a4u-9611000000-b70cd68ac6a7388b2eb5
Source of Spectrum QC-1-195-4
Wiley ID 882857