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Hexacosyl ferulate, mono-TMS
SpectraBase Compound ID 3Lq9fMlbUpp
InChI InChI=1S/C39H70O4Si/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-34-42-39(40)33-31-36-30-32-37(38(35-36)41-2)43-44(3,4)5/h30-33,35H,6-29,34H2,1-5H3/b33-31+
InChIKey GIEGKSADSYAOOU-QOSDPKFLSA-N
Mol Weight 631.1 g/mol
Molecular Formula C39H70O4Si
Exact Mass 630.504337 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3v7dU6RQsOM
Name Hexacosyl ferulate, mono-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 630.504337265 u
Formula C39H70O4Si
GC Column HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness)
InChI InChI=1S/C39H70O4Si/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-34-42-39(40)33-31-36-30-32-37(38(35-36)41-2)43-44(3,4)5/h30-33,35H,6-29,34H2,1-5H3/b33-31+
InChIKey GIEGKSADSYAOOU-QOSDPKFLSA-N
Molecular Weight 631.070 g/mol
Nominal Mass 630 u
Number of Peaks 190
SMILES c1(O[Si](C)(C)C)c(cc(cc1)\C=C\C(OCCCCCCCCCCCCCCCCCCCCCCCCCC)=O)OC
SPLASH splash10-0002-3290000000-73eb4c7b7640058b9714
Source poplar (P. balsamifera) bark
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
Synonyms 1-Hexacosyl ferulate, mono-TMS
Wiley ID VI001002