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1-OCTYL-DERIVATIVE
SpectraBase Compound ID KW85yK1H5d4
InChI InChI=1S/C30H48Cl2N2O7/c1-3-4-5-6-7-8-20-39-30-27(33-22(2)36)29(28(38)25(21-35)40-30)41-26(37)11-9-10-23-12-14-24(15-13-23)34(18-16-31)19-17-32/h12-15,25,27-30,35,38H,3-11,16-21H2,1-2H3,(H,33,36)/t25-,27-,28-,29-,30-/m1/s1
InChIKey SNSOKPAVRSJGDF-VDFIJDOYSA-N
Mol Weight 619.6 g/mol
Molecular Formula C30H48Cl2N2O7
Exact Mass 618.283857 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JVGccVZZYpO
Name 1-OCTYL-DERIVATIVE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H48Cl2N2O7
InChI InChI=1S/C30H48Cl2N2O7/c1-3-4-5-6-7-8-20-39-30-27(33-22(2)36)29(28(38)25(21-35)40-30)41-26(37)11-9-10-23-12-14-24(15-13-23)34(18-16-31)19-17-32/h12-15,25,27-30,35,38H,3-11,16-21H2,1-2H3,(H,33,36)/t25-,27-,28-,29-,30-/m1/s1
InChIKey SNSOKPAVRSJGDF-VDFIJDOYSA-N
Literature Reference Author F.IGLESIAS-GUERRA,J.I.CANDELA,J.BAUTISTA,F.ALCUDIA,J.M.VEGA- PEREZ
Literature Reference Citation CARBOHYDR.RES.,316,71(1999)
Literature Reference DOI 10.1016/S0008-6215(99)00030-0
Molecular Weight 619.626 g/mol
Solvent CDCl3
Source File Reference UWMP15099