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2-(2-Methylphenyl)-1,3-dioxo-5-isoindolinecarboxylic acid, tms derivative
SpectraBase Compound ID 4EL1bhONqvk
InChI InChI=1S/C19H19NO4Si/c1-12-7-5-6-8-16(12)20-17(21)14-10-9-13(11-15(14)18(20)22)19(23)24-25(2,3)4/h5-11H,1-4H3
InChIKey INVHOOLLYSFITQ-UHFFFAOYSA-N
Mol Weight 353.45 g/mol
Molecular Formula C19H19NO4Si
Exact Mass 353.108335 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CvUJ26sKblH
Name 2-(2-Methylphenyl)-1,3-dioxo-5-isoindolinecarboxylic acid, tms derivative
Comments Computed using HOSE algorithm
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Exact Mass 353.108334627 u
Formula C19H19NO4Si
InChI InChI=1S/C19H19NO4Si/c1-12-7-5-6-8-16(12)20-17(21)14-10-9-13(11-15(14)18(20)22)19(23)24-25(2,3)4/h5-11H,1-4H3
InChIKey INVHOOLLYSFITQ-UHFFFAOYSA-N
Molecular Weight 353.449 g/mol
SMILES C1(N(C(C2=C1C=C(C=C2)C(=O)O[Si](C)(C)C)=O)C1=C(C=CC=C1)C)=O