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[(2R,3R,4S,5R,6S)-5-acetoxy-6-benzyloxy-3,4-dihydroxy-tetrahydropyran-2-yl]methyl acetate
SpectraBase Compound ID 3IHJkXsY9T8
InChI InChI=1S/C17H22O8/c1-10(18)22-9-13-14(20)15(21)16(24-11(2)19)17(25-13)23-8-12-6-4-3-5-7-12/h3-7,13-17,20-21H,8-9H2,1-2H3/t13-,14+,15+,16-,17+/m1/s1
InChIKey LAWWQPPCBUKFCD-HMDCTGQHSA-N
Mol Weight 354.36 g/mol
Molecular Formula C17H22O8
Exact Mass 354.131468 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Lo6vCLt5fO9
Name [(2R,3R,4S,5R,6S)-5-Acetoxy-6-benzyloxy-3,4-dihydroxy-tetrahydropyran-2-yl]methyl acetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 354.131467660 u
Formula C17H22O8
InChI InChI=1S/C17H22O8/c1-10(18)22-9-13-14(20)15(21)16(24-11(2)19)17(25-13)23-8-12-6-4-3-5-7-12/h3-7,13-17,20-21H,8-9H2,1-2H3/t13-,14+,15+,16-,17+/m1/s1
InChIKey LAWWQPPCBUKFCD-HMDCTGQHSA-N
Molecular Weight 354.355 g/mol
SMILES [C@@]1([C@]([C@@](O)([C@](O[C@@]1(OCC=1C=CC=CC1)[H])(COC(=O)C)[H])[H])(O)[H])(OC(=O)C)[H]