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Aloe-emodin TMS
SpectraBase Compound ID 6htBnU03dkT
InChI InChI=1S/C18H18O5Si/c1-24(2,3)23-9-10-7-12-16(14(20)8-10)18(22)15-11(17(12)21)5-4-6-13(15)19/h4-8,19-20H,9H2,1-3H3
InChIKey VFAHUXLAJTWTSW-UHFFFAOYSA-N
Mol Weight 342.42 g/mol
Molecular Formula C18H18O5Si
Exact Mass 342.09235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2vITOHHbZg
Name Aloe-emodin TMS
Classification Laxative
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Exact Mass 342.092350210 u
Formula C18H18O5Si
InChI InChI=1S/C18H18O5Si/c1-24(2,3)23-9-10-7-12-16(14(20)8-10)18(22)15-11(17(12)21)5-4-6-13(15)19/h4-8,19-20H,9H2,1-3H3
InChIKey VFAHUXLAJTWTSW-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 342.422 g/mol
SMILES c1ccc2C(c3c(c(cc(c3)CO[Si](C)(C)C)O)C(c2c1O)=O)=O
SPLASH splash10-03di-4229000000-ccb618dddbe29d43ebd0
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
Technique GC/MS
Wiley ID MMPW6e_3575