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Methyl 2,5,8,11,14,17,20,23,26,29-decaoxahentriacontan-31-oate

View entire compound with spectra: 1 NMR

Methyl 2,5,8,11,14,17,20,23,26,29-decaoxahentriacontan-31-oate
SpectraBase Compound ID m1WmO3SIDR
InChI InChI=1S/C22H44O12/c1-24-3-4-26-5-6-27-7-8-28-9-10-29-11-12-30-13-14-31-15-16-32-17-18-33-19-20-34-21-22(23)25-2/h3-21H2,1-2H3
InChIKey WPOZZXYNORBSJH-UHFFFAOYSA-N
Mol Weight 500.6 g/mol
Molecular Formula C22H44O12
Exact Mass 500.283277 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GbH3OBGKEwa
Name Methyl 2,5,8,11,14,17,20,23,26,29-decaoxahentriacontan-31-oate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 500.283276845 u
Formula C22H44O12
InChI InChI=1S/C22H44O12/c1-24-3-4-26-5-6-27-7-8-28-9-10-29-11-12-30-13-14-31-15-16-32-17-18-33-19-20-34-21-22(23)25-2/h3-21H2,1-2H3
InChIKey WPOZZXYNORBSJH-UHFFFAOYSA-N
Molecular Weight 500.582 g/mol
SMILES COCCOCCOCCOCCOCCOCCOCCOCCOCCOCC(OC)=O