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Quinolinic acid, di-TMS
SpectraBase Compound ID LuJSg7ZKeQb
InChI InChI=1S/C13H21NO4Si2/c1-19(2,3)17-12(15)10-8-7-9-14-11(10)13(16)18-20(4,5)6/h7-9H,1-6H3
InChIKey FUIIPFHUXKUVDX-UHFFFAOYSA-N
Mol Weight 311.48 g/mol
Molecular Formula C13H21NO4Si2
Exact Mass 311.100911 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bz9GZDCbXNb
Name Pyridine-2,3-dicarboxylic acid, 2TMS
Comments Derivatization type: 2 TMS (mass: 311.101); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000385; Note: The molecular formula of the structure shown is C7H5NO4 - which differs from the formula reported for the mass spectrum (C13H21NO4Si2)
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Formula C13H21NO4Si2
InChI InChI=1S/C13H21NO4Si2/c1-19(2,3)17-12(15)10-8-7-9-14-11(10)13(16)18-20(4,5)6/h7-9H,1-6H3
InChIKey FUIIPFHUXKUVDX-UHFFFAOYSA-N
Molecular Weight 311.484 g/mol
SMILES c1cc(c(C(=O)O[Si](C)(C)C)nc1)C(=O)O[Si](C)(C)C
SPLASH splash10-0002-1950000000-f5d83dbff28fdb06e856
Source of Spectrum FM-2019-385-0
Synonyms quinolinic acid, 2TMS quinolinate, 2TMS 2,3-pyridinedicarboxylic acid, 2TMS Pyridine-2,3-dicarboxylic acid, 2TMS Pyridine-2,3-carboxylate, 2TMS Spectrum_001525, 2TMS bis(trimethylsilyl) pyridine-2,3-dicarboxylate
Wiley ID 1818072