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N,N-Dimethyl-2,3-anhydro-4,5:7,8-di-o-isopropylidene-D-erythro-L-gluco-octonamide
SpectraBase Compound ID LURS1hZfEDx
InChI InChI=1S/C16H27NO7/c1-15(2)20-7-8(22-15)9(18)10-12(24-16(3,4)23-10)11-13(21-11)14(19)17(5)6/h8-13,18H,7H2,1-6H3/t8?,9?,10?,11-,12?,13+/m1/s1
InChIKey GZYIYVALZCXYCK-FRGXYRPNSA-N
Mol Weight 345.39 g/mol
Molecular Formula C16H27NO7
Exact Mass 345.178752 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7ErteeCgGxi
Name N,N-Dimethyl-2,3-anhydro-4,5:7,8-di-o-isopropylidene-D-erythro-L-gluco-octonamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 345.178752206 u
Formula C16H27NO7
InChI InChI=1S/C16H27NO7/c1-15(2)20-7-8(22-15)9(18)10-12(24-16(3,4)23-10)11-13(21-11)14(19)17(5)6/h8-13,18H,7H2,1-6H3/t8?,9?,10?,11-,12?,13+/m1/s1
InChIKey GZYIYVALZCXYCK-FRGXYRPNSA-N
Molecular Weight 345.392 g/mol
SMILES [C@@]1([C@](C2C(OC(O2)(C)C)C(C2OC(C)(C)OC2)O)([H])O1)(C(N(C)C)=O)[H]