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4-Oxododecanedioic acid, 2tms
SpectraBase Compound ID D9eO7pudBv3
InChI InChI=1S/C18H36O5Si2/c1-24(2,3)22-17(20)13-11-9-7-8-10-12-16(19)14-15-18(21)23-25(4,5)6/h7-15H2,1-6H3
InChIKey JGTIBJDMBFOTIX-UHFFFAOYSA-N
Mol Weight 388.7 g/mol
Molecular Formula C18H36O5Si2
Exact Mass 388.210127 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID As0HOXcZzGf
Name 4-Oxododecanedioic acid, 2tms
Comments Computed using HOSE algorithm
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Exact Mass 388.210127324 u
Formula C18H36O5Si2
InChI InChI=1S/C18H36O5Si2/c1-24(2,3)22-17(20)13-11-9-7-8-10-12-16(19)14-15-18(21)23-25(4,5)6/h7-15H2,1-6H3
InChIKey JGTIBJDMBFOTIX-UHFFFAOYSA-N
Molecular Weight 388.651 g/mol
SMILES C(=O)(O[Si](C)(C)C)CCCCCCCC(CCC(=O)O[Si](C)(C)C)=O