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Butyl 2,5,8,11,14,17,20,23,26-nonaoxaoctacosan-28-oate

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Butyl 2,5,8,11,14,17,20,23,26-nonaoxaoctacosan-28-oate
SpectraBase Compound ID HA5sl49t2X9
InChI InChI=1S/C23H46O11/c1-3-4-5-34-23(24)22-33-21-20-32-19-18-31-17-16-30-15-14-29-13-12-28-11-10-27-9-8-26-7-6-25-2/h3-22H2,1-2H3
InChIKey LRDORCANSGTFJH-UHFFFAOYSA-N
Mol Weight 498.6 g/mol
Molecular Formula C23H46O11
Exact Mass 498.304012 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BUaY73u7O93
Name Butyl 2,5,8,11,14,17,20,23,26-nonaoxaoctacosan-28-oate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 498.304012290 u
Formula C23H46O11
InChI InChI=1S/C23H46O11/c1-3-4-5-34-23(24)22-33-21-20-32-19-18-31-17-16-30-15-14-29-13-12-28-11-10-27-9-8-26-7-6-25-2/h3-22H2,1-2H3
InChIKey LRDORCANSGTFJH-UHFFFAOYSA-N
Molecular Weight 498.610 g/mol
SMILES COCCOCCOCCOCCOCCOCCOCCOCCOCC(OCCCC)=O