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8-(Tetrahydropyran-2-yloxy)decane-2,4-dione isomer
SpectraBase Compound ID 9UT6nKea3it
InChI InChI=1S/C15H26O4/c1-3-14(19-15-9-4-5-10-18-15)8-6-7-13(17)11-12(2)16/h14-15H,3-11H2,1-2H3
InChIKey MHVFHXLMOQCAFG-UHFFFAOYSA-N
Mol Weight 270.37 g/mol
Molecular Formula C15H26O4
Exact Mass 270.183109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3fdc8N31bo9
Name 8-(Tetrahydropyran-2-yloxy)decane-2,4-dione isomer
Comments Computed using HOSE algorithm
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Exact Mass 270.183109313 u
Formula C15H26O4
InChI InChI=1S/C15H26O4/c1-3-14(19-15-9-4-5-10-18-15)8-6-7-13(17)11-12(2)16/h14-15H,3-11H2,1-2H3
InChIKey MHVFHXLMOQCAFG-UHFFFAOYSA-N
Molecular Weight 270.369 g/mol
SMILES C1(OCCCC1)OC(CCCC(CC(=O)C)=O)CC