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Hexatrimethylsilyl-trans-4-O-caffeoyl-D-quinic acid
SpectraBase Compound ID 8oF93wYEGpT
InChI InChI=1S/C34H66O9Si6/c1-44(2,3)38-27-21-19-26(23-28(27)39-45(4,5)6)20-22-31(35)37-32-29(40-46(7,8)9)24-34(43-49(16,17)18,33(36)42-48(13,14)15)25-30(32)41-47(10,11)12/h19-23,29-30,32H,24-25H2,1-18H3/b22-20+/t29-,30-,32-,34+/m1/s1
InChIKey TVNYJEUSYBSSPM-UYAFOJLTSA-N
Mol Weight 787.4 g/mol
Molecular Formula C34H66O9Si6
Exact Mass 786.332243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C43YJpqXDyB
Name Hexatrimethylsilyl-trans-4-O-caffeoyl-D-quinic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H66O9Si6
InChI InChI=1S/C34H66O9Si6/c1-44(2,3)38-27-21-19-26(23-28(27)39-45(4,5)6)20-22-31(35)37-32-29(40-46(7,8)9)24-34(43-49(16,17)18,33(36)42-48(13,14)15)25-30(32)41-47(10,11)12/h19-23,29-30,32H,24-25H2,1-18H3/b22-20+/t29-,30-,32-,34+/m1/s1
InChIKey TVNYJEUSYBSSPM-UYAFOJLTSA-N
Molecular Weight 787.403 g/mol
SMILES [C@]1(C(O[Si](C)(C)C)=O)(C[C@@](O[Si](C)(C)C)([C@]([C@@](C1)(O[Si](C)(C)C)[H])(OC(\C=C\c1cc(O[Si](C)(C)C)c(cc1)O[Si](C)(C)C)=O)[H])[H])O[Si](C)(C)C
SPLASH splash10-0a4i-1039100100-bf4ae0c623f5a847a2b3
Source of Spectrum O-31-602-0
Wiley ID 1416962