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Bisoprolol TMSTFA
SpectraBase Compound ID Lvo0mUxZlqB
InChI InChI=1S/C23H38F3NO5Si/c1-17(2)27(22(28)23(24,25)26)14-21(32-33(5,6)7)16-31-20-10-8-19(9-11-20)15-29-12-13-30-18(3)4/h8-11,17-18,21H,12-16H2,1-7H3
InChIKey VYMVSQMPUNKAED-UHFFFAOYSA-N
Mol Weight 493.6 g/mol
Molecular Formula C23H38F3NO5Si
Exact Mass 493.247134 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 78uHdTVE4Hq
Name Bisoprolol TMSTFA
Classification Beta-Blocker
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Exact Mass 493.247134347 u
Formula C23H38F3NO5Si
InChI InChI=1S/C23H38F3NO5Si/c1-17(2)27(22(28)23(24,25)26)14-21(32-33(5,6)7)16-31-20-10-8-19(9-11-20)15-29-12-13-30-18(3)4/h8-11,17-18,21H,12-16H2,1-7H3
InChIKey VYMVSQMPUNKAED-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 493.639 g/mol
SMILES c1c(ccc(c1)COCCOC(C)C)OCC(CN(C(C(F)(F)F)=O)C(C)C)O[Si](C)(C)C
SPLASH splash10-00ai-6790000000-5c8988a68f1ad7bc170a
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_6134