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alpha-D-Glucofuranose, 1,2-o-(1-methylethylidene)-3-o-[[4-(pentyloxy)phenyl]methyl]-
SpectraBase Compound ID HPiry9fzlnE
InChI InChI=1S/C21H32O7/c1-4-5-6-11-24-15-9-7-14(8-10-15)13-25-18-17(16(23)12-22)26-20-19(18)27-21(2,3)28-20/h7-10,16-20,22-23H,4-6,11-13H2,1-3H3
InChIKey KCCMKEJSKZURTI-UHFFFAOYSA-N
Mol Weight 396.5 g/mol
Molecular Formula C21H32O7
Exact Mass 396.214803 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Eh5Y27wFOCI
Name alpha-D-Glucofuranose, 1,2-o-(1-methylethylidene)-3-o-[[4-(pentyloxy)phenyl]methyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 396.214803363 u
Formula C21H32O7
InChI InChI=1S/C21H32O7/c1-4-5-6-11-24-15-9-7-14(8-10-15)13-25-18-17(16(23)12-22)26-20-19(18)27-21(2,3)28-20/h7-10,16-20,22-23H,4-6,11-13H2,1-3H3
InChIKey KCCMKEJSKZURTI-UHFFFAOYSA-N
Molecular Weight 396.480 g/mol
SMILES OC(CO)C1C(C2C(O1)OC(O2)(C)C)OCC1=CC=C(C=C1)OCCCCC