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Butylphosphonic acid, tetradecyl 2-(2-methoxyethyl)hexyl ester

View entire compound with spectra: 1 NMR

Butylphosphonic acid, tetradecyl 2-(2-methoxyethyl)hexyl ester
SpectraBase Compound ID 4etdLdyJ42t
InChI InChI=1S/C27H57O4P/c1-5-8-11-12-13-14-15-16-17-18-19-20-23-30-32(28,25-10-7-3)31-26-27(21-9-6-2)22-24-29-4/h27H,5-26H2,1-4H3
InChIKey HFMVQTFSDBEAKH-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 5UCewCgYvjH
Name Butylphosphonic acid, tetradecyl 2-(2-methoxyethyl)hexyl ester
Comments Computed using HOSE algorithm
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Exact Mass 476.399447309 u
Formula C27H57O4P
InChI InChI=1S/C27H57O4P/c1-5-8-11-12-13-14-15-16-17-18-19-20-23-30-32(28,25-10-7-3)31-26-27(21-9-6-2)22-24-29-4/h27H,5-26H2,1-4H3
InChIKey HFMVQTFSDBEAKH-UHFFFAOYSA-N
Molecular Weight 476.723 g/mol
SMILES C(CCCCCCCCCCCOP(OCC(CCCC)CCOC)(CCCC)=O)CC