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Glutaric acid, neopentyl pentyl ester
SpectraBase Compound ID GfxWFfwLYQl
InChI InChI=1S/C15H28O4/c1-5-6-7-11-18-13(16)9-8-10-14(17)19-12-15(2,3)4/h5-12H2,1-4H3
InChIKey XDAMTRZDKRNXOO-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 EF8tTztIZpi
Name Glutaric acid, neopentyl pentyl ester
Comments Computed using HOSE algorithm
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Exact Mass 272.198759378 u
Formula C15H28O4
InChI InChI=1S/C15H28O4/c1-5-6-7-11-18-13(16)9-8-10-14(17)19-12-15(2,3)4/h5-12H2,1-4H3
InChIKey XDAMTRZDKRNXOO-UHFFFAOYSA-N
SMILES CCCCCOC(CCCC(OCC(C)(C)C)=O)=O