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2-[(2S,3S,4R)-2-[(Z)-2-phenylethenyl]-3,4-bis(phenylmethoxy)-2-oxolanyl]ethanethioic acid S-tert-butyl ester
SpectraBase Compound ID Hui7WCTOyss
InChI InChI=1S/C32H36O4S/c1-31(2,3)37-29(33)21-32(20-19-25-13-7-4-8-14-25)30(35-23-27-17-11-6-12-18-27)28(24-36-32)34-22-26-15-9-5-10-16-26/h4-20,28,30H,21-24H2,1-3H3/b20-19-/t28-,30+,32-/m1/s1
InChIKey HUQQRELVLHNXIV-LLCLVEMXSA-N
Mol Weight 516.7 g/mol
Molecular Formula C32H36O4S
Exact Mass 516.233431 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID zDAF8E2Jk
Name 2-[(2S,3S,4R)-2-[(Z)-2-phenylethenyl]-3,4-bis(phenylmethoxy)-2-oxolanyl]ethanethioic acid S-tert-butyl ester
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Formula C32H36O4S
InChI InChI=1S/C32H36O4S/c1-31(2,3)37-29(33)21-32(20-19-25-13-7-4-8-14-25)30(35-23-27-17-11-6-12-18-27)28(24-36-32)34-22-26-15-9-5-10-16-26/h4-20,28,30H,21-24H2,1-3H3/b20-19-/t28-,30+,32-/m1/s1
InChIKey HUQQRELVLHNXIV-LLCLVEMXSA-N
Molecular Weight 516.696 g/mol
SMILES [C@@]1([C@@](OCc2ccccc2)([C@](OCc2ccccc2)(CO1)[H])[H])(CC(SC(C)(C)C)=O)\C=C/c1ccccc1
SPLASH splash10-0a7l-9431000000-dbdf5cb0c718e495e5e1
Source of Spectrum J-62-8101-27
Synonyms 2-[(2S,3S,4R)-3,4-dibenzoxy-2-[(Z)-styryl]tetrahydrofuran-2-yl]ethanethioic acid S-tert-butyl ester S-tert-butyl 2-[(2S,3S,4R)-2-[(Z)-2-phenylethenyl]-3,4-bis(phenylmethoxy)oxolan-2-yl]ethanethioate S-tert-butyl 2-[(2S,3S,4R)-3,4-dibenzyloxy-2-[(Z)-styryl]tetrahydrofuran-2-yl]ethanethioate
Wiley ID 1401467