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3,6,9,12-Tetraoxatetradecane-1,14-diyl dibenzoate
SpectraBase Compound ID JfavEBKOV0C
InChI InChI=1S/C24H30O8/c25-23(21-7-3-1-4-8-21)31-19-17-29-15-13-27-11-12-28-14-16-30-18-20-32-24(26)22-9-5-2-6-10-22/h1-10H,11-20H2
InChIKey CFVLGWAKOSEJCR-UHFFFAOYSA-N
Mol Weight 446.5 g/mol
Molecular Formula C24H30O8
Exact Mass 446.194068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cn44IynEHfA
Name 3,6,9,12-Tetraoxatetradecane-1,14-diyl dibenzoate
Comments Computed using HOSE algorithm
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Exact Mass 446.194067918 u
Formula C24H30O8
InChI InChI=1S/C24H30O8/c25-23(21-7-3-1-4-8-21)31-19-17-29-15-13-27-11-12-28-14-16-30-18-20-32-24(26)22-9-5-2-6-10-22/h1-10H,11-20H2
InChIKey CFVLGWAKOSEJCR-UHFFFAOYSA-N
Molecular Weight 446.496 g/mol
SMILES C(OCCOCCOCCOC(=O)C1=CC=CC=C1)COCCOC(=O)C1=CC=CC=C1