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alpha-D-6-Benzoyl-2,3,4-triacetyl-

View entire compound with spectra: 2 NMR

alpha-D-6-Benzoyl-2,3,4-triacetyl-
SpectraBase Compound ID JFqdQGTCels
InChI InChI=1S/C19H21BrO9/c1-10(21)26-15-14(9-25-19(24)13-7-5-4-6-8-13)29-18(20)17(28-12(3)23)16(15)27-11(2)22/h4-8,14-18H,9H2,1-3H3/t14-,15+,16+,17-,18+/m1/s1
InChIKey KQHVWXMAPSWFST-ICUGJSFKSA-N
Mol Weight 473.27 g/mol
Molecular Formula C19H21BrO9
Exact Mass 472.036895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 38vBKIPXtrh
Name alpha-D-6-Benzoyl-2,3,4-triacetyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 472.036895247 u
Formula C19H21BrO9
InChI InChI=1S/C19H21BrO9/c1-10(21)26-15-14(9-25-19(24)13-7-5-4-6-8-13)29-18(20)17(28-12(3)23)16(15)27-11(2)22/h4-8,14-18H,9H2,1-3H3/t14-,15+,16+,17-,18+/m1/s1
InChIKey KQHVWXMAPSWFST-ICUGJSFKSA-N
Molecular Weight 473.272 g/mol
SMILES CC(=O)O[C@]1([C@@](Br)(O[C@](COC(c2ccccc2)=O)([C@](OC(C)=O)([C@@]1(OC(C)=O)[H])[H])[H])[H])[H]