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Heptanedioic acid bis(trimethylsilyl)ester
SpectraBase Compound ID J97UyjwrWoN
InChI InChI=1S/C13H28O4Si2/c1-18(2,3)16-12(14)10-8-7-9-11-13(15)17-19(4,5)6/h7-11H2,1-6H3
InChIKey VOLKRTUGJXKFMI-UHFFFAOYSA-N
Mol Weight 304.53 g/mol
Molecular Formula C13H28O4Si2
Exact Mass 304.152612 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HmPANYydnkf
Name pimelic acid, 2TMS
Comments Derivatization type: 2 TMS (mass: 304.153); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000827; Note: The molecular formula of the structure shown is C7H12O4 - which differs from the formula reported for the mass spectrum (C13H28O4Si2)
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Formula C13H28O4Si2
InChI InChI=1S/C13H28O4Si2/c1-18(2,3)16-12(14)10-8-7-9-11-13(15)17-19(4,5)6/h7-11H2,1-6H3
InChIKey VOLKRTUGJXKFMI-UHFFFAOYSA-N
Molecular Weight 304.533 g/mol
SMILES C(CCC(=O)O[Si](C)(C)C)CCC(=O)O[Si](C)(C)C
SPLASH splash10-054k-1900000000-1290ecf1ca11332ee97d
Source of Spectrum FM-2019-827-0
Synonyms Heptanedioic acid, 2TMS pimelate, 2TMS Pileric acid, 2TMS Heptandioic acid, 2TMS Heptanedioate, 2TMS Heptanedioic acid, 2TMS bis(trimethylsilyl) heptanedioate
Wiley ID 1818501