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(S)-3-Methoxy-2,2-dimethyl-4-((2R,3S)-3-p-tolylsulfanyl-tetrahydro-pyran-2-yl)-butyric acid methyl ester
SpectraBase Compound ID ELCKthfdUna
InChI InChI=1S/C20H30O4S/c1-14-8-10-15(11-9-14)25-17-7-6-12-24-16(17)13-18(22-4)20(2,3)19(21)23-5/h8-11,16-18H,6-7,12-13H2,1-5H3/t16-,17+,18+/m1/s1
InChIKey PBDWGFZEUHYMKY-SQNIBIBYSA-N
Mol Weight 366.52 g/mol
Molecular Formula C20H30O4S
Exact Mass 366.186481 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9OGK3TcPlLR
Name (S)-3-Methoxy-2,2-dimethyl-4-((2R,3S)-3-p-tolylsulfanyl-tetrahydro-pyran-2-yl)-butyric acid methyl ester
Alternate Name(s) 2-[2'-Methoxy-3'-(methoxycarbonyl)-3'-methylbutyl]-3-(4''-tolylthio)tetrahydropyran Methyl (3S)-3-methoxy-2,2-dimethyl-4-{(2R,3S)-3-[(4-methylphenyl)sulfanyl]tetrahydro-2H-pyran-2-yl}butanoate trans-2-((S)-2'-Methoxy-3'-methoxycarbonyl-3'-methylbutyl)-3-(4-tolylthio)tretrahydropyran disteromer trans-2-(2'-Methoxy-3'-methoxycarbonyl-3'-methylbutyl)-3-(4-tolylthio)tretrahydropyran disteromer trans-2-[(S)-2'-Methoxy-3'-(methoxycarbonyl)-3'-methylbutyl]-3-(4''-tolylthio)tetrahydropyran
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Formula C20H30O4S
InChI InChI=1S/C20H30O4S/c1-14-8-10-15(11-9-14)25-17-7-6-12-24-16(17)13-18(22-4)20(2,3)19(21)23-5/h8-11,16-18H,6-7,12-13H2,1-5H3/t16-,17+,18+/m1/s1
InChIKey PBDWGFZEUHYMKY-SQNIBIBYSA-N
Molecular Weight 366.516 g/mol
SMILES C(C(=O)OC)([C@](C[C@@]1([C@@](Sc2ccc(cc2)C)(CCCO1)[H])[H])(OC)[H])(C)C
SPLASH splash10-03di-0941000000-6066a94c06ee91f85360
Source of Spectrum QF-49-94-9
Wiley ID 1547875