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sinapyl dihydroferulate diacetate
SpectraBase Compound ID AHOXvoragXC
InChI InChI=1S/C25H28O9/c1-16(26)33-20-10-8-18(13-21(20)29-3)9-11-24(28)32-12-6-7-19-14-22(30-4)25(34-17(2)27)23(15-19)31-5/h6-8,10,13-15H,9,11-12H2,1-5H3/b7-6+
InChIKey PWAMPTOAOCERLK-VOTSOKGWSA-N
Mol Weight 472.49 g/mol
Molecular Formula C25H28O9
Exact Mass 472.173332 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5c5dvrzURxO
Name sinapyl dihydroferulate diacetate
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H28O9
GC Oven Program Oven temp 300oC, Split injection (20:1) injector
InChI InChI=1S/C25H28O9/c1-16(26)33-20-10-8-18(13-21(20)29-3)9-11-24(28)32-12-6-7-19-14-22(30-4)25(34-17(2)27)23(15-19)31-5/h6-8,10,13-15H,9,11-12H2,1-5H3/b7-6+
InChIKey PWAMPTOAOCERLK-VOTSOKGWSA-N
Instrument Name GC-2010 Plus-GCMS-TQ8030
Ionization Type EI
Molecular Weight 472.490 g/mol
SMILES c1cc(cc(c1OC(C)=O)OC)CCC(OC\C=C\c1cc(c(c(c1)OC)OC(C)=O)OC)=O
SPLASH splash10-03el-0911100000-4d42bc363dd2acff22d5
Source of Spectrum US10227287B2
Wiley ID 1879707