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Phosphoric acid, diheptyl methyl ester
SpectraBase Compound ID 4bkODx1ZR4p
InChI InChI=1S/C15H33O4P/c1-4-6-8-10-12-14-18-20(16,17-3)19-15-13-11-9-7-5-2/h4-15H2,1-3H3
InChIKey GBXSEMWYVJHRPN-UHFFFAOYSA-N
Mol Weight 308.4 g/mol
Molecular Formula C15H33O4P
Exact Mass 308.211647 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Xw9M6b0JXh
Name Phosphoric acid, diheptyl methyl ester
Comments Computed using HOSE algorithm
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Exact Mass 308.211646537 u
Formula C15H33O4P
InChI InChI=1S/C15H33O4P/c1-4-6-8-10-12-14-18-20(16,17-3)19-15-13-11-9-7-5-2/h4-15H2,1-3H3
InChIKey GBXSEMWYVJHRPN-UHFFFAOYSA-N
Molecular Weight 308.399 g/mol
SMILES CCCCCCCOP(OCCCCCCC)(OC)=O