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(2R,3R)-3-[(1R,4S,5R)-5-((E)-5-(Benzenesulfonyl-3-methyl-3-pentenyl)-1-methyl-4-(2-methyl[1,3]dioxolan-2-yl)-2-cyclopentenylmethyl]-2-methyloxiranylmethyl methanesulfonate
SpectraBase Compound ID 3FalHCfMre8
InChI InChI=1S/C28H40O8S2/c1-21(14-18-38(31,32)22-9-7-6-8-10-22)11-12-23-24(28(4)33-16-17-34-28)13-15-26(23,2)19-25-27(3,36-25)20-35-37(5,29)30/h6-10,13-15,23-25H,11-12,16-20H2,1-5H3/b21-14+/t23-,24-,25-,26-,27-/m1/s1
InChIKey SEENWRUOCJLNMP-SZEYMFKJSA-N
Mol Weight 568.7 g/mol
Molecular Formula C28H40O8S2
Exact Mass 568.216461 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lf86DPlERew
Name (2R,3R)-3-[(1R,4S,5R)-5-((E)-5-(Benzenesulfonyl-3-methyl-3-pentenyl)-1-methyl-4-(2-methyl[1,3]dioxolan-2-yl)-2-cyclopentenylmethyl]-2-methyloxiranylmethyl methanesulfonate
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Formula C28H40O8S2
InChI InChI=1S/C28H40O8S2/c1-21(14-18-38(31,32)22-9-7-6-8-10-22)11-12-23-24(28(4)33-16-17-34-28)13-15-26(23,2)19-25-27(3,36-25)20-35-37(5,29)30/h6-10,13-15,23-25H,11-12,16-20H2,1-5H3/b21-14+/t23-,24-,25-,26-,27-/m1/s1
InChIKey SEENWRUOCJLNMP-SZEYMFKJSA-N
Molecular Weight 568.740 g/mol
SMILES [C@]1(O[C@@]1(C[C@@]1([C@@]([C@](C2(OCCO2)C)(C=C1)[H])(CC\C(=C\CS(=O)(=O)c1ccccc1)C)[H])C)[H])(COS(=O)(=O)C)C
SPLASH splash10-000i-9000000000-0194c5c3f7ad0d84c123
Source of Spectrum F-59-71-26
Wiley ID 1712075