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N-Methoxy-N-methyl-4-benzyloxy-2-phenylsulfonyl-5,6:7,8-bis(isopropylidenedioxy)octanamide
SpectraBase Compound ID U7SsAwSQ7l
InChI InChI=1S/C29H39NO9S/c1-28(2)36-19-23(37-28)26-25(38-29(3,4)39-26)22(35-18-20-13-9-7-10-14-20)17-24(27(31)30(5)34-6)40(32,33)21-15-11-8-12-16-21/h7-16,22-26H,17-19H2,1-6H3/t22-,23+,24?,25-,26-/m0/s1
InChIKey QKOCRXJROLBKTA-ABVWSBSUSA-N
Mol Weight 577.7 g/mol
Molecular Formula C29H39NO9S
Exact Mass 577.234553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HdrpHXi6rBp
Name N-Methoxy-N-methyl-4-benzyloxy-2-phenylsulfonyl-5,6:7,8-bis(isopropylidenedioxy)octanamide
Alternate Name(s) (S)-2-Benzenesulfonyl-4-benzyloxy-N-methoxy-N-methyl-4-((4S,5S,4'R)-2,2,2',2'-tetramethyl-[4,4']bi[[1,3]dioxolanyl]-5-yl)-butyramide 2-(benzenesulfonyl)-4-(benzyloxy)-4-[5-(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyl-1,3-dioxolan-4-yl]-N-methoxy-N-methylbutanamide
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Formula C29H39NO9S
InChI InChI=1S/C29H39NO9S/c1-28(2)36-19-23(37-28)26-25(38-29(3,4)39-26)22(35-18-20-13-9-7-10-14-20)17-24(27(31)30(5)34-6)40(32,33)21-15-11-8-12-16-21/h7-16,22-26H,17-19H2,1-6H3/t22-,23+,24?,25-,26-/m0/s1
InChIKey QKOCRXJROLBKTA-ABVWSBSUSA-N
Molecular Weight 577.689 g/mol
SMILES C(S(=O)(=O)c1ccccc1)(C(N(OC)C)=O)C[C@@]([C@]1([C@]([C@@]2(OC(C)(C)OC2)[H])(OC(O1)(C)C)[H])[H])(OCc1ccccc1)[H]
SPLASH splash10-0006-9400000000-c359369758f2768799a0
Source of Spectrum SO-0-377-7
Wiley ID 877413