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3,5-Dimethoxy-4-hydroxy-cis-cinnamic acid, 2TMS
SpectraBase Compound ID FKfd8rbghkj
InChI InChI=1S/C17H28O5Si2/c1-19-14-11-13(9-10-16(18)21-23(3,4)5)12-15(20-2)17(14)22-24(6,7)8/h9-12H,1-8H3/b10-9-
InChIKey LKLXWSPPLVNURP-KTKRTIGZSA-N
Mol Weight 368.58 g/mol
Molecular Formula C17H28O5Si2
Exact Mass 368.147527 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JPOHl4f4RaH
Name 3,5-Dimethoxy-4-hydroxy-cis-cinnamic acid, 2TMS
Comments Derivatization type: 2 TMS (mass: 368.148); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000179; Note: The molecular formula of the structure shown is C11H12O5 - which differs from the formula reported for the mass spectrum (C17H28O5Si2)
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Formula C17H28O5Si2
InChI InChI=1S/C17H28O5Si2/c1-19-14-11-13(9-10-16(18)21-23(3,4)5)12-15(20-2)17(14)22-24(6,7)8/h9-12H,1-8H3/b10-9-
InChIKey LKLXWSPPLVNURP-KTKRTIGZSA-N
Molecular Weight 368.576 g/mol
SMILES COc1cc(\C=C/C(=O)O[Si](C)(C)C)cc(c1O[Si](C)(C)C)OC
SPLASH splash10-000i-2956000000-1b75821438b2d6d32642
Source of Spectrum FM-2019-179-0
Synonyms Sinapinic acid, 2TMS SINAPIC ACID, 2TMS EINECS 208-487-3, 2TMS NSC 59261, 2TMS 4-Hydroxy-3,5-dimethoxycinnamic acid, 2TMS 530-59-6, 2TMS (Z)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid, 2TMS Trimethylsilyl (Z)-3-(3,5-dimethoxy-4-((trimethylsilyl)oxy)phenyl)acrylate
Wiley ID 1817870