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Caffeic acid <(Z)->, tri-TMS
SpectraBase Compound ID Jg3Y0R1hkEX
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-QBFSEMIESA-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 2LeHVziam0
Name Caffeic acid, cis-(3TMS)
Carrier Gas Helium (1ml/min)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 396.160839111 u
Formula C18H32O4Si3
GC Column ZB-5HT INFERNO (30 m x 0.25 mm, film thickness 0.10 micrometer)
GC Oven Program Oven temp 375oC
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-QBFSEMIESA-N
Inlet Type Splitless
Instrument Name Thermo Scientific Trace 1300 GC-MS-ISQ Single Quadrupole
Ionization Type EI
Literature Reference DOI 10.1016/j.arabjc.2022.104103
Molecular Weight 396.705 g/mol
Quality 32
SMILES C1=C(C=CC(=C1O[Si](C)(C)C)O[Si](C)(C)C)\C=C/C(O[Si](C)(C)C)=O
SPLASH splash10-01b9-7290000000-b2bb44622a50645058ba
Source of Spectrum AJC-15-104108-35A (DOI: 10.1016/j.arabjc.2022.104103)
Wiley ID 1908125