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Neryl sinapinate, mono-TMS
SpectraBase Compound ID 95nz4xnBPO2
InChI InChI=1S/C24H36O5Si/c1-18(2)10-9-11-19(3)14-15-28-23(25)13-12-20-16-21(26-4)24(22(17-20)27-5)29-30(6,7)8/h10,12-14,16-17H,9,11,15H2,1-8H3/b13-12+,19-14+
InChIKey CRROSHLJAXSTFN-OGMPJXADSA-N
Mol Weight 432.6 g/mol
Molecular Formula C24H36O5Si
Exact Mass 432.233201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7iWiHWi86EN
Name Geranyl sinapinate, 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 432.233200789 u
Formula C24H36O5Si
GC Column HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness)
InChI InChI=1S/C24H36O5Si/c1-18(2)10-9-11-19(3)14-15-28-23(25)13-12-20-16-21(26-4)24(22(17-20)27-5)29-30(6,7)8/h10,12-14,16-17H,9,11,15H2,1-8H3/b13-12+,19-14+
InChIKey CRROSHLJAXSTFN-OGMPJXADSA-N
Molecular Weight 432.632 g/mol
Nominal Mass 432 u
Number of Peaks 265
SMILES c1c(cc(c(c1OC)O[Si](C)(C)C)OC)\C=C\C(OC\C=C\(CCC=C(C)C)C)=O
SPLASH splash10-015a-2190100000-c48d20100d6331eeaab5
Source P. Walejko
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
Wiley ID VI000410