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Phosphorous acid, tridecyl ester
SpectraBase Compound ID 1EkWBflNd2J
InChI InChI=1S/C30H63O3P/c1-4-7-10-13-16-19-22-25-28-31-34(32-29-26-23-20-17-14-11-8-5-2)33-30-27-24-21-18-15-12-9-6-3/h4-30H2,1-3H3
InChIKey QQBLOZGVRHAYGT-UHFFFAOYSA-N
Mol Weight 502.8 g/mol
Molecular Formula C30H63O3P
Exact Mass 502.451483 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AGhzaO06Dd9
Name Phosphorous acid, tridecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 502.451482884 u
Formula C30H63O3P
InChI InChI=1S/C30H63O3P/c1-4-7-10-13-16-19-22-25-28-31-34(32-29-26-23-20-17-14-11-8-5-2)33-30-27-24-21-18-15-12-9-6-3/h4-30H2,1-3H3
InChIKey QQBLOZGVRHAYGT-UHFFFAOYSA-N
Molecular Weight 502.805 g/mol
SMILES C(CC)CCCCCCCOP(OCCCCCCCCCC)OCCCCCCCCCC