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Atenolol 2TMS
SpectraBase Compound ID DkKqiqprZuP
InChI InChI=1S/C20H38N2O3Si2/c1-16(2)21-14-19(25-27(6,7)8)15-24-18-11-9-17(10-12-18)13-20(23)22-26(3,4)5/h9-12,16,19,21H,13-15H2,1-8H3,(H,22,23)
InChIKey VOIUKOKBRRBCHK-UHFFFAOYSA-N
Mol Weight 410.7 g/mol
Molecular Formula C20H38N2O3Si2
Exact Mass 410.242096 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9UY8XR1p3KY
Name Atenolol 2TMS
Classification Beta-Blocker
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Exact Mass 410.242096159 u
Formula C20H38N2O3Si2
InChI InChI=1S/C20H38N2O3Si2/c1-16(2)21-14-19(25-27(6,7)8)15-24-18-11-9-17(10-12-18)13-20(23)22-26(3,4)5/h9-12,16,19,21H,13-15H2,1-8H3,(H,22,23)
InChIKey VOIUKOKBRRBCHK-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 410.705 g/mol
SMILES C(N[Si](C)(C)C)(=O)Cc1ccc(OCC(O[Si](C)(C)C)CNC(C)C)cc1
SPLASH splash10-00di-9310000000-bf63b8df12afd66a3a19
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_5471