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(R*)-Ethyl 2,6-dimethylbenzoyloxy-[( 4-methylphenyl)sulfanyl]acetate
SpectraBase Compound ID HOp0qz2kUBx
InChI InChI=1S/C20H22O4S/c1-5-23-19(22)20(4,24-18(21)16-9-7-6-8-10-16)25-17-12-11-14(2)13-15(17)3/h6-13H,5H2,1-4H3/t20-/m1/s1
InChIKey BOZMCFGANFPKPY-HXUWFJFHSA-N
Mol Weight 358.45 g/mol
Molecular Formula C20H22O4S
Exact Mass 358.12388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID fSGOGqSVRl
Name (R*)-Ethyl 2,6-dimethylbenzoyloxy-[( 4-methylphenyl)sulfanyl]acetate
Comments Less than 3 mono-isotopic peaks
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Formula C20H22O4S
InChI InChI=1S/C20H22O4S/c1-5-23-19(22)20(4,24-18(21)16-9-7-6-8-10-16)25-17-12-11-14(2)13-15(17)3/h6-13H,5H2,1-4H3/t20-/m1/s1
InChIKey BOZMCFGANFPKPY-HXUWFJFHSA-N
Molecular Weight 358.452 g/mol
SMILES [C@](OC(=O)c1ccccc1)(Sc1c(cc(cc1)C)C)(C(=O)OCC)C
SPLASH splash10-001i-0903000000-68afa17a6731b3e49ea7
Source of Spectrum QC-8-308-5
Synonyms (1R)-1-[(2,4-dimethylphenyl)sulfanyl]-2-ethoxy-1-methyl-2-oxoethyl benzoate
Wiley ID 869616