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Toliprolol TMSTFA
SpectraBase Compound ID EFpefJrQ3rz
InChI InChI=1S/C18H28F3NO3Si/c1-13(2)22(17(23)18(19,20)21)11-16(25-26(4,5)6)12-24-15-9-7-8-14(3)10-15/h7-10,13,16H,11-12H2,1-6H3
InChIKey TYQSINXSXOPQLF-UHFFFAOYSA-N
Mol Weight 391.51 g/mol
Molecular Formula C18H28F3NO3Si
Exact Mass 391.179055 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D6zpmbGia7q
Name Toliprolol TMSTFA
Classification Beta-Blocker
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Exact Mass 391.179054787 u
Formula C18H28F3NO3Si
InChI InChI=1S/C18H28F3NO3Si/c1-13(2)22(17(23)18(19,20)21)11-16(25-26(4,5)6)12-24-15-9-7-8-14(3)10-15/h7-10,13,16H,11-12H2,1-6H3
InChIKey TYQSINXSXOPQLF-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 391.506 g/mol
SMILES C(O[Si](C)(C)C)(CN(C(C)C)C(C(F)(F)F)=O)COc1cc(ccc1)C
SPLASH splash10-00ai-7930000000-73cbbf920ed94d3536a4
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_6174