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2-(Tripalmitoylpentaerythrytyloxy)-2-oxo-1,3,2-dioxaphosphorinane

View entire compound with spectra: 2 NMR

2-(Tripalmitoylpentaerythrytyloxy)-2-oxo-1,3,2-dioxaphosphorinane
SpectraBase Compound ID F52ShcTldhr
InChI InChI=1S/C56H107O10P/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-44-53(57)61-49-56(52-66-67(60)64-47-43-48-65-67,50-62-54(58)45-41-38-35-32-29-26-23-20-17-14-11-8-5-2)51-63-55(59)46-42-39-36-33-30-27-24-21-18-15-12-9-6-3/h4-52H2,1-3H3
InChIKey WSDCIXHLAORJEI-UHFFFAOYSA-N
Mol Weight 971.4 g/mol
Molecular Formula C56H107O10P
Exact Mass 970.760187 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2R2hSZuXjdh
Name 2-(Tripalmitoylpentaerythrytyloxy)-2-oxo-1,3,2-dioxaphosphorinane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 970.760186633 u
Formula C56H107O10P
InChI InChI=1S/C56H107O10P/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-44-53(57)61-49-56(52-66-67(60)64-47-43-48-65-67,50-62-54(58)45-41-38-35-32-29-26-23-20-17-14-11-8-5-2)51-63-55(59)46-42-39-36-33-30-27-24-21-18-15-12-9-6-3/h4-52H2,1-3H3
InChIKey WSDCIXHLAORJEI-UHFFFAOYSA-N
Molecular Weight 971.436 g/mol
SMILES C1OP(OCC1)(OCC(COC(=O)CCCCCCCCCCCCCCC)(COC(=O)CCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCC)=O