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4-(Hexyloxy)phenyl 2,3,4,6-tetra-o-acetylhexopyranoside

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4-(Hexyloxy)phenyl 2,3,4,6-tetra-o-acetylhexopyranoside
SpectraBase Compound ID 86gE5wjJKLX
InChI InChI=1S/C26H36O11/c1-6-7-8-9-14-31-20-10-12-21(13-11-20)36-26-25(35-19(5)30)24(34-18(4)29)23(33-17(3)28)22(37-26)15-32-16(2)27/h10-13,22-26H,6-9,14-15H2,1-5H3/t22-,23-,24+,25-,26-/m1/s1
InChIKey SAIBZJRVPYUMMD-WSGIOKLISA-N
Mol Weight 524.6 g/mol
Molecular Formula C26H36O11
Exact Mass 524.225762 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EfI3ekXrMuH
Name 4-(Hexyloxy)phenyl 2,3,4,6-tetra-o-acetylhexopyranoside
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 524.225761968 u
Formula C26H36O11
InChI InChI=1S/C26H36O11/c1-6-7-8-9-14-31-20-10-12-21(13-11-20)36-26-25(35-19(5)30)24(34-18(4)29)23(33-17(3)28)22(37-26)15-32-16(2)27/h10-13,22-26H,6-9,14-15H2,1-5H3/t22-,23-,24+,25-,26-/m1/s1
InChIKey SAIBZJRVPYUMMD-WSGIOKLISA-N
Molecular Weight 524.563 g/mol
SMILES [C@@]1([C@]([C@](OC(=O)C)([C@](O[C@]1(OC1=CC=C(C=C1)OCCCCCC)[H])(COC(=O)C)[H])[H])(OC(=O)C)[H])(OC(=O)C)[H]