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Phosphoric acid, dioctyl undecyl ester
SpectraBase Compound ID LikP9ZksMQp
InChI InChI=1S/C27H57O4P/c1-4-7-10-13-16-17-18-21-24-27-31-32(28,29-25-22-19-14-11-8-5-2)30-26-23-20-15-12-9-6-3/h4-27H2,1-3H3
InChIKey HDGAFCQSTQJXKZ-UHFFFAOYSA-N
Mol Weight 476.7 g/mol
Molecular Formula C27H57O4P
Exact Mass 476.399447 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2PCUU6gwQzY
Name Phosphoric acid, dioctyl undecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 476.399447309 u
Formula C27H57O4P
InChI InChI=1S/C27H57O4P/c1-4-7-10-13-16-17-18-21-24-27-31-32(28,29-25-22-19-14-11-8-5-2)30-26-23-20-15-12-9-6-3/h4-27H2,1-3H3
InChIKey HDGAFCQSTQJXKZ-UHFFFAOYSA-N
Molecular Weight 476.723 g/mol
SMILES CCCCCCCCCCCOP(OCCCCCCCC)(OCCCCCCCC)=O