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1,11-Diphenylundecane-4,4,8,8-tetracarboxylic acid tetraethylester
SpectraBase Compound ID 3hI6WBTwabr
InChI InChI=1S/C35H48O8/c1-5-40-30(36)34(31(37)41-6-2,24-15-22-28-18-11-9-12-19-28)26-17-27-35(32(38)42-7-3,33(39)43-8-4)25-16-23-29-20-13-10-14-21-29/h9-14,18-21H,5-8,15-17,22-27H2,1-4H3
InChIKey YRIKYBIOSIVICM-UHFFFAOYSA-N
Mol Weight 596.8 g/mol
Molecular Formula C35H48O8
Exact Mass 596.334918 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3fWqpGEX5qr
Name 1,11-Diphenylundecane-4,4,8,8-tetracarboxylic acid tetraethylester
Comments Computed using HOSE algorithm
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Exact Mass 596.334918498 u
Formula C35H48O8
InChI InChI=1S/C35H48O8/c1-5-40-30(36)34(31(37)41-6-2,24-15-22-28-18-11-9-12-19-28)26-17-27-35(32(38)42-7-3,33(39)43-8-4)25-16-23-29-20-13-10-14-21-29/h9-14,18-21H,5-8,15-17,22-27H2,1-4H3
InChIKey YRIKYBIOSIVICM-UHFFFAOYSA-N
Molecular Weight 596.761 g/mol
SMILES C(=O)(OCC)C(C(OCC)=O)(CCCC(C(OCC)=O)(C(OCC)=O)CCCC1=CC=CC=C1)CCCC1=CC=CC=C1