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Betaxolol TMSTFA
SpectraBase Compound ID koXCNkEC3f
InChI InChI=1S/C23H36F3NO4Si/c1-17(2)27(22(28)23(24,25)26)14-21(31-32(3,4)5)16-30-20-10-8-18(9-11-20)12-13-29-15-19-6-7-19/h8-11,17,19,21H,6-7,12-16H2,1-5H3
InChIKey YMLDSODZZKDBCG-UHFFFAOYSA-N
Mol Weight 475.6 g/mol
Molecular Formula C23H36F3NO4Si
Exact Mass 475.23657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GBXfwTi25tv
Name Betaxolol TMSTFA
Classification Beta-Blocker
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Exact Mass 475.236569663 u
Formula C23H36F3NO4Si
InChI InChI=1S/C23H36F3NO4Si/c1-17(2)27(22(28)23(24,25)26)14-21(31-32(3,4)5)16-30-20-10-8-18(9-11-20)12-13-29-15-19-6-7-19/h8-11,17,19,21H,6-7,12-16H2,1-5H3
InChIKey YMLDSODZZKDBCG-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 475.624 g/mol
SMILES c1c(ccc(c1)CCOCC1CC1)OCC(CN(C(C)C)C(=O)C(F)(F)F)O[Si](C)(C)C
SPLASH splash10-05cr-9760000000-5122df6309fc5ea3cb1d
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_6179