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Citronellyl sinapinate, mono-TMS
SpectraBase Compound ID BFi7hD2Ip9K
InChI InChI=1S/C24H38O5Si/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/h10,12-13,16-17,19H,9,11,14-15H2,1-8H3/b13-12+
InChIKey MPIAIQAEUZVAMQ-OUKQBFOZSA-N
Mol Weight 434.6 g/mol
Molecular Formula C24H38O5Si
Exact Mass 434.248851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8b4ckHRg7KX
Name Citronellyl 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 434.248850854 u
Formula C24H38O5Si
GC Column HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness)
InChI InChI=1S/C24H38O5Si/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/h10,12-13,16-17,19H,9,11,14-15H2,1-8H3/b13-12+
InChIKey MPIAIQAEUZVAMQ-OUKQBFOZSA-N
Molecular Weight 434.648 g/mol
Nominal Mass 434 u
Number of Peaks 185
SMILES C(CCC=C(C)C)(CCOC(\C=C\c1cc(c(c(c1)OC)O[Si](C)(C)C)OC)=O)C
SPLASH splash10-015a-2190100000-f0d7cb1b0174c5f52053
Source P. Walejko
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
Wiley ID VI000408