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3,6,9,12-Tetraoxatetradecan-1-ol, 14-(nonylphenoxy)-
SpectraBase Compound ID IIATkWhgYjL
InChI InChI=1S/C25H44O6/c1-2-3-4-5-6-7-8-9-24-10-12-25(13-11-24)31-23-22-30-21-20-29-19-18-28-17-16-27-15-14-26/h10-13,26H,2-9,14-23H2,1H3
InChIKey PITRRWWILGYENJ-UHFFFAOYSA-N
Mol Weight 440.6 g/mol
Molecular Formula C25H44O6
Exact Mass 440.313789 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5yeYjDYZKQx
Name 3,6,9,12-Tetraoxatetradecan-1-ol, 14-(nonylphenoxy)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 440.313789131 u
Formula C25H44O6
InChI InChI=1S/C25H44O6/c1-2-3-4-5-6-7-8-9-24-10-12-25(13-11-24)31-23-22-30-21-20-29-19-18-28-17-16-27-15-14-26/h10-13,26H,2-9,14-23H2,1H3
InChIKey PITRRWWILGYENJ-UHFFFAOYSA-N
Molecular Weight 440.621 g/mol
SMILES C(O)COCCOCCOCCOCCOC1=CC=C(C=C1)CCCCCCCCC