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2-Propenoic acid, 3-[3,4-bis[(trimethylsilyl)oxy]phenyl]-, trimethylsilyl ester
SpectraBase Compound ID JisF1WHbPHP
InChI InChI=1S/C18H32O4Si3/c1-23(2,3)20-16-12-10-15(14-17(16)21-24(4,5)6)11-13-18(19)22-25(7,8)9/h10-14H,1-9H3/b13-11+
InChIKey MBIYCWDFSLHMSI-ACCUITESSA-N
Mol Weight 396.7 g/mol
Molecular Formula C18H32O4Si3
Exact Mass 396.160839 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JsRETBphDGw
Name Caffeic acid 3TMS @
CAS Registry Number 10586-03-5
Classification Plant ingredient
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Exact Mass 396.160839111 u
Formula C18H32O4Si3
InChI InChI=1S/C18H32O4Si3/c1-23(2,3)20-16-12-10-15(14-17(16)21-24(4,5)6)11-13-18(19)22-25(7,8)9/h10-14H,1-9H3/b13-11+
InChIKey MBIYCWDFSLHMSI-ACCUITESSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 396.705 g/mol
SMILES c1(cc(\C=C\C(=O)O[Si](C)(C)C)ccc1O[Si](C)(C)C)O[Si](C)(C)C
SPLASH splash10-00r2-6369000000-cfcbf49dffc74442107b
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms 3,4-Dihydroxycinnamic acid 3TMS
Technique GC/MS
Wiley ID MMPW6e_6014