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1.beta.-[p-(Toluenesulfonyl)oxy]-2.beta.,3.beta.-epoxy-4.beta.-[(benzyloxycarbonyl)amino]-6.alpha.-[(t-butyldimethylsilyl)oxy]cycloheptane
SpectraBase Compound ID D0EzjJcWFi4
InChI InChI=1S/C28H39NO7SSi/c1-19-12-14-22(15-13-19)37(31,32)35-24-17-21(36-38(5,6)28(2,3)4)16-23(25-26(24)34-25)29-27(30)33-18-20-10-8-7-9-11-20/h7-15,21,23-26H,16-18H2,1-6H3,(H,29,30)/t21-,23-,24+,25-,26+/m1/s1
InChIKey ANPASFWAKUYWCL-ZGLCYIBRSA-N
Mol Weight 561.8 g/mol
Molecular Formula C28H39NO7SSi
Exact Mass 561.22165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4d4hDosjo02
Name 1.beta.-[p-(Toluenesulfonyl)oxy]-2.beta.,3.beta.-epoxy-4.beta.-[(benzyloxycarbonyl)amino]-6.alpha.-[(t-butyldimethylsilyl)oxy]cycloheptane
Alternate Name(s) (1R,2S,4R,6R,7R)-6-{[(benzyloxy)carbonyl]amino}-4-{[tert-butyl(dimethyl)silyl]oxy}-8-oxabicyclo[5.1.0]oct-2-yl 4-methylbenzenesulfonate
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Formula C28H39NO7SSi
InChI InChI=1S/C28H39NO7SSi/c1-19-12-14-22(15-13-19)37(31,32)35-24-17-21(36-38(5,6)28(2,3)4)16-23(25-26(24)34-25)29-27(30)33-18-20-10-8-7-9-11-20/h7-15,21,23-26H,16-18H2,1-6H3,(H,29,30)/t21-,23-,24+,25-,26+/m1/s1
InChIKey ANPASFWAKUYWCL-ZGLCYIBRSA-N
Molecular Weight 561.765 g/mol
SMILES N(C(=O)OCc1ccccc1)[C@]1([C@@]2([C@@](O2)([C@@](OS(c2ccc(cc2)C)(=O)=O)(C[C@](O[Si](C(C)(C)C)(C)C)(C1)[H])[H])[H])[H])[H]
SPLASH splash10-0006-9010000000-66da03e481bfd2bccbf5
Source of Spectrum F-52-11988-16
Wiley ID 798601