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2-Hydroxy-6-[(Z)-nonadec-8-enyl]benzoic acid, 2tms derivative
SpectraBase Compound ID DLB4TofXoQ5
InChI InChI=1S/C32H58O3Si2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-26-29-27-25-28-30(34-36(2,3)4)31(29)32(33)35-37(5,6)7/h17-18,25,27-28H,8-16,19-24,26H2,1-7H3/b18-17-
InChIKey BJIAZMMMFZKOAI-ZCXUNETKSA-N
Mol Weight 547.0 g/mol
Molecular Formula C32H58O3Si2
Exact Mass 546.392449 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IPHp515GMi7
Name 2-Hydroxy-6-[(Z)-nonadec-8-enyl]benzoic acid, 2tms derivative
Comments Computed using HOSE algorithm
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Exact Mass 546.392448795 u
Formula C32H58O3Si2
InChI InChI=1S/C32H58O3Si2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-26-29-27-25-28-30(34-36(2,3)4)31(29)32(33)35-37(5,6)7/h17-18,25,27-28H,8-16,19-24,26H2,1-7H3/b18-17-
InChIKey BJIAZMMMFZKOAI-ZCXUNETKSA-N
Molecular Weight 546.983 g/mol
SMILES C(C1=C(C=CC=C1CCCCCCC\C=C/CCCCCCCCCC)O[Si](C)(C)C)(=O)O[Si](C)(C)C