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(2R,3S)-2-((3R)-3'-Methoxy-2'-methyl-5'-oxohex-2'-yl)-3-(4-tolylthio)tretrahydropyran
SpectraBase Compound ID 3Jz1sZyJARd
InChI InChI=1S/C20H30O3S/c1-14-8-10-16(11-9-14)24-17-7-6-12-23-19(17)20(3,4)18(22-5)13-15(2)21/h8-11,17-19H,6-7,12-13H2,1-5H3/t17-,18+,19-/m0/s1
InChIKey RKBSBIBXUSSJJA-OTWHNJEPSA-N
Mol Weight 350.52 g/mol
Molecular Formula C20H30O3S
Exact Mass 350.191566 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GpYAiqBhmls
Name (2R,3S)-2-((3R)-3'-Methoxy-2'-methyl-5'-oxohex-2'-yl)-3-(4-tolylthio)tretrahydropyran
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O3S
InChI InChI=1S/C20H30O3S/c1-14-8-10-16(11-9-14)24-17-7-6-12-23-19(17)20(3,4)18(22-5)13-15(2)21/h8-11,17-19H,6-7,12-13H2,1-5H3/t17-,18+,19-/m0/s1
InChIKey RKBSBIBXUSSJJA-OTWHNJEPSA-N
Molecular Weight 350.517 g/mol
SMILES C([C@@]1([C@@](Sc2ccc(cc2)C)(CCCO1)[H])[H])([C@@](CC(=O)C)(OC)[H])(C)C
SPLASH splash10-052f-7940000000-fed02841849b8938e382
Source of Spectrum QF-49-94-12
Synonyms (R)-4-Methoxy-5-methyl-5-((2R,3S)-3-p-tolylsulfanyl-tetrahydro-pyran-2-yl)-hexan-2-one (2R,3S)-2-[(R)-3'-Methoxy-2'-methyl-5'-oxohex-2'-yl]-3-(4''-tolylthio)tetrahydropyran (4R)-4-methoxy-5-methyl-5-{(2R,3S)-3-[(4-methylphenyl)sulfanyl]tetrahydro-2H-pyran-2-yl}-2-hexanone 2-[3'-Methoxy-2'-methyl-5'-oxohex-2'-yl]-3-(4''-tolylthio)tetrahydropyran trans-2-((R)-3'-Methoxy-2'-methyl-5'-oxohex-2'-enyl)-3-(4-tolylthio)tretrahydropyran trans-2-(3'-Methoxy-2'-methyl-5'-oxohex-2'-enyl)-3-(4-tolylthio)tretrahydropyran trans-2-((R)-3'-Methoxy-2'-methyl-5'-oxohex-2'-enyl)-3-(4-tolylthio)tretrahydropyran disteromer trans-2-(3'-Methoxy-2'-methyl-5'-oxohex-2'-enyl)-3-(4-tolylthio)tretrahydropyran disteromer
Wiley ID 1547873