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1,2,3-o-Tribenzyl-.alpha.,D-arabinopyranose-4-carboxylic acid

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1,2,3-o-Tribenzyl-.alpha.,D-arabinopyranose-4-carboxylic acid
SpectraBase Compound ID 46rum7ylIOL
InChI InChI=1S/C27H28O6/c28-20-33-24-19-32-27(31-18-23-14-8-3-9-15-23)26(30-17-22-12-6-2-7-13-22)25(24)29-16-21-10-4-1-5-11-21/h1-15,20,24-27H,16-19H2/t24-,25-,26-,27+/m1/s1
InChIKey QVWGMPXCNVEFEJ-CWTOASCOSA-N
Mol Weight 448.52 g/mol
Molecular Formula C27H28O6
Exact Mass 448.188589 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6kD9RpJBS29
Name 1,2,3-o-Tribenzyl-.alpha.,D-arabinopyranose-4-carboxylic acid
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 448.188588616 u
Formula C27H28O6
InChI InChI=1S/C27H28O6/c28-20-33-24-19-32-27(31-18-23-14-8-3-9-15-23)26(30-17-22-12-6-2-7-13-22)25(24)29-16-21-10-4-1-5-11-21/h1-15,20,24-27H,16-19H2/t24-,25-,26-,27+/m1/s1
InChIKey QVWGMPXCNVEFEJ-CWTOASCOSA-N
Molecular Weight 448.515 g/mol
SMILES [C@@]1([C@](OCC2=CC=CC=C2)([C@](OC=O)(CO[C@@]1(OCC=1C=CC=CC1)[H])[H])[H])(OCC1=CC=CC=C1)[H]