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Glutaric acid, di(2-pentyl) ester
SpectraBase Compound ID BAUYVVqm0Wh
InChI InChI=1S/C15H28O4/c1-5-8-12(3)18-14(16)10-7-11-15(17)19-13(4)9-6-2/h12-13H,5-11H2,1-4H3
InChIKey PCYXICPRLLAZFI-UHFFFAOYSA-N
Mol Weight 272.38 g/mol
Molecular Formula C15H28O4
Exact Mass 272.198759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Gf26q9LbwtN
Name Glutaric acid, di(2-pentyl) ester
Comments Computed using HOSE algorithm
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Exact Mass 272.198759378 u
Formula C15H28O4
InChI InChI=1S/C15H28O4/c1-5-8-12(3)18-14(16)10-7-11-15(17)19-13(4)9-6-2/h12-13H,5-11H2,1-4H3
InChIKey PCYXICPRLLAZFI-UHFFFAOYSA-N
SMILES CC(CCC)OC(CCCC(OC(CCC)C)=O)=O