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Heneicosanedioic acid, di-TMS
SpectraBase Compound ID FD0TJgHvQkm
InChI InChI=1S/C27H56O4Si2/c1-32(2,3)30-26(28)24-22-20-18-16-14-12-10-8-7-9-11-13-15-17-19-21-23-25-27(29)31-33(4,5)6/h7-25H2,1-6H3
InChIKey NERMVDXNISZCEU-UHFFFAOYSA-N
Mol Weight 500.9 g/mol
Molecular Formula C27H56O4Si2
Exact Mass 500.371713 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KjqqMdoZpOZ
Name Heneicosanedioic 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 500.371713349 u
Formula C27H56O4Si2
GC Column HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness)
InChI InChI=1S/C27H56O4Si2/c1-32(2,3)30-26(28)24-22-20-18-16-14-12-10-8-7-9-11-13-15-17-19-21-23-25-27(29)31-33(4,5)6/h7-25H2,1-6H3
InChIKey NERMVDXNISZCEU-UHFFFAOYSA-N
Molecular Weight 500.911 g/mol
Nominal Mass 500 u
Number of Peaks 118
SMILES C(CCCCCCCCCCCCCC(O[Si](C)(C)C)=O)CCCCCC(=O)O[Si](C)(C)C
SPLASH splash10-0g2i-9530300000-e77b6595d8c3a9634782
Source birch (B. pubescens) twigs, SFE extract
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
Wiley ID VI000980