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5-Hydroxyindole-2-carboxylic acid, 3TMS
SpectraBase Compound ID 4XFnBhUtMf5
InChI InChI=1S/C18H31NO3Si3/c1-23(2,3)19-16-11-10-15(21-24(4,5)6)12-14(16)13-17(19)18(20)22-25(7,8)9/h10-13H,1-9H3
InChIKey QPFORFRULMAKLP-UHFFFAOYSA-N
Mol Weight 393.71 g/mol
Molecular Formula C18H31NO3Si3
Exact Mass 393.161173 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7U439awOxNM
Name 5-Hydroxyindole-2-carboxylic acid, 3TMS
Comments Derivatization type: 3 TMS (mass: 393.161); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000576; Note: The molecular formula of the structure shown is C9H7NO3 - which differs from the formula reported for the mass spectrum (C18H31NO3Si3)
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Formula C18H31NO3Si3
InChI InChI=1S/C18H31NO3Si3/c1-23(2,3)19-16-11-10-15(21-24(4,5)6)12-14(16)13-17(19)18(20)22-25(7,8)9/h10-13H,1-9H3
InChIKey QPFORFRULMAKLP-UHFFFAOYSA-N
Molecular Weight 393.705 g/mol
SMILES c1cc2c(cc1O[Si](C)(C)C)cc(C(=O)O[Si](C)(C)C)[n]2[Si](C)(C)C
SPLASH splash10-004j-0956000000-e9bce0da0cad412a5c6d
Source of Spectrum FM-2019-576-0
Synonyms 5-Hydroxyindole-2-carboxylic acid, 3TMS 143510_ALDRICH, 3TMS STOCK2S-00977, 3TMS 55355_FLUKA, 3TMS 5-Hydroxy-2-indolecarboxylic acid, 3TMS EINECS 244-468-6, 3TMS 5-Hydroxy-1H-indole-2-carboxylic acid, 3TMS Trimethylsilyl 1-(trimethylsilyl)-5-((trimethylsilyl)oxy)-1H-indole-2-carboxylate
Wiley ID 1818257