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3-Furancarboxylic acid, 2,5-dihydro-2-(14-hydroxypentadecyl)-4-methyl-5-oxo-, methyl ester

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

3-Furancarboxylic acid, 2,5-dihydro-2-(14-hydroxypentadecyl)-4-methyl-5-oxo-, methyl ester
SpectraBase Compound ID G6SWnXjmPLR
InChI InChI=1S/C22H38O5/c1-17(23)15-13-11-9-7-5-4-6-8-10-12-14-16-19-20(22(25)26-3)18(2)21(24)27-19/h17,19,23H,4-16H2,1-3H3
InChIKey YKOITUXDSZZSAZ-UHFFFAOYSA-N
Mol Weight 382.5 g/mol
Molecular Formula C22H38O5
Exact Mass 382.271924 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1WA5rLelufc
Name 3-Furancarboxylic acid, 2,5-dihydro-2-(14-hydroxypentadecyl)-4-methyl-5-oxo-, methyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 382.271924319 u
Formula C22H38O5
InChI InChI=1S/C22H38O5/c1-17(23)15-13-11-9-7-5-4-6-8-10-12-14-16-19-20(22(25)26-3)18(2)21(24)27-19/h17,19,23H,4-16H2,1-3H3
InChIKey YKOITUXDSZZSAZ-UHFFFAOYSA-N
Molecular Weight 382.541 g/mol
SMILES C1(=C(C(=O)OC1CCCCCCCCCCCCCC(O)C)C)C(=O)OC