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Docosanedioic acid, di-TMS
SpectraBase Compound ID EHQAwfZzULF
InChI InChI=1S/C28H58O4Si2/c1-33(2,3)31-27(29)25-23-21-19-17-15-13-11-9-7-8-10-12-14-16-18-20-22-24-26-28(30)32-34(4,5)6/h7-26H2,1-6H3
InChIKey XASHCOSQAQJDCO-UHFFFAOYSA-N
Mol Weight 514.9 g/mol
Molecular Formula C28H58O4Si2
Exact Mass 514.387363 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HUVxKk83ACX
Name Docosanedioic acid, di-TMS
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 514.387363414 u
Formula C28H58O4Si2
GC Column HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness)
InChI InChI=1S/C28H58O4Si2/c1-33(2,3)31-27(29)25-23-21-19-17-15-13-11-9-7-8-10-12-14-16-18-20-22-24-26-28(30)32-34(4,5)6/h7-26H2,1-6H3
InChIKey XASHCOSQAQJDCO-UHFFFAOYSA-N
Molecular Weight 514.938 g/mol
Nominal Mass 514 u
Number of Peaks 146
SMILES C(CCCCCCCCCCCC(=O)O[Si](C)(C)C)CCCCCCCCC(O[Si](C)(C)C)=O
SPLASH splash10-0g2a-7941000000-6860769f76bb9e68206b
Source birch (B. pubescens) twigs
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
Wiley ID VI000981