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.alpha.-D-Galactopyranose, 6-deoxy-6-[3-[2-(methoxycarbonyl)phenyl]-1-triazenyl]-1,2:3,4-bis-o-(1-methylethylidene)-
SpectraBase Compound ID 8b77HSv5RWa
InChI InChI=1S/C20H27N3O7/c1-19(2)27-14-13(26-18-16(15(14)28-19)29-20(3,4)30-18)10-21-23-22-12-9-7-6-8-11(12)17(24)25-5/h6-9,13-16,18H,10H2,1-5H3,(H,21,22)/t13-,14+,15+,16-,18-/m1/s1
InChIKey VGBSWOIGERNHKW-QYXWGXCQSA-N
Mol Weight 421.45 g/mol
Molecular Formula C20H27N3O7
Exact Mass 421.1849 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ryqeV5rYJr
Name .alpha.-D-Galactopyranose, 6-deoxy-6-[3-[2-(methoxycarbonyl)phenyl]-1-triazenyl]-1,2:3,4-bis-o-(1-methylethylidene)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 421.184900214 u
Formula C20H27N3O7
InChI InChI=1S/C20H27N3O7/c1-19(2)27-14-13(26-18-16(15(14)28-19)29-20(3,4)30-18)10-21-23-22-12-9-7-6-8-11(12)17(24)25-5/h6-9,13-16,18H,10H2,1-5H3,(H,21,22)/t13-,14+,15+,16-,18-/m1/s1
InChIKey VGBSWOIGERNHKW-QYXWGXCQSA-N
Molecular Weight 421.450 g/mol
SMILES [C@]12([C@@]3([C@@](OC(O3)(C)C)([C@](O[C@@]1(OC(O2)(C)C)[H])(C\N=N\NC=1C(C(=O)OC)=CC=CC1)[H])[H])[H])[H]