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Pentanedioic acid, 3-methyl-3-[(trimethylsilyl)oxy]-, bis(trimethylsilyl) ester
SpectraBase Compound ID 3hKR9mzOIqE
InChI InChI=1S/C15H34O5Si3/c1-15(20-23(8,9)10,11-13(16)18-21(2,3)4)12-14(17)19-22(5,6)7/h11-12H2,1-10H3
InChIKey SWDDFRVEZJUJJD-UHFFFAOYSA-N
Mol Weight 378.7 g/mol
Molecular Formula C15H34O5Si3
Exact Mass 378.171404 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LhtaJKIMukx
Name 3-Hydroxy-3-methylglutaric acid, 3TMS
Comments Derivatization type: 3 TMS (mass: 378.171); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000586; Note: The molecular formula of the structure shown is C6H10O5 - which differs from the formula reported for the mass spectrum (C15H34O5Si3)
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Formula C15H34O5Si3
InChI InChI=1S/C15H34O5Si3/c1-15(20-23(8,9)10,11-13(16)18-21(2,3)4)12-14(17)19-22(5,6)7/h11-12H2,1-10H3
InChIKey SWDDFRVEZJUJJD-UHFFFAOYSA-N
Molecular Weight 378.687 g/mol
SMILES CC(CC(=O)O[Si](C)(C)C)(CC(=O)O[Si](C)(C)C)O[Si](C)(C)C
SPLASH splash10-0002-0920000000-8f7af4d64971a7a6962f
Source of Spectrum FM-2019-586-0
Synonyms Dicrotalic acid, 3TMS Lipoglutaren, 3TMS MEGLUTOL, 3TMS Medroglutaric acid, 3TMS HMGA, 3TMS (S)-Meglutol, 3TMS 3-Hydroxy-3-methylpentanedioic acid, 3TMS bis(trimethylsilyl) 3-methyl-3-((trimethylsilyl)oxy)pentanedioate
Wiley ID 1818267