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Bisoprolol -H2O
SpectraBase Compound ID 1eZ4JZ3Cp2r
InChI InChI=1S/C18H29NO3/c1-15(2)19-10-5-11-22-18-8-6-17(7-9-18)14-20-12-13-21-16(3)4/h5-9,11,15-16,19H,10,12-14H2,1-4H3/b11-5+
InChIKey JZRKUNUKKCUCNI-VZUCSPMQSA-N
Mol Weight 307.43 g/mol
Molecular Formula C18H29NO3
Exact Mass 307.214744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K0rnX2t2dTJ
Name Bisoprolol -H2O
Classification Beta-Blocker
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Exact Mass 307.214743795 u
Formula C18H29NO3
InChI InChI=1S/C18H29NO3/c1-15(2)19-10-5-11-22-18-8-6-17(7-9-18)14-20-12-13-21-16(3)4/h5-9,11,15-16,19H,10,12-14H2,1-4H3/b11-5+
InChIKey JZRKUNUKKCUCNI-VZUCSPMQSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 307.434 g/mol
SMILES c1c(ccc(COCCOC(C)C)c1)O\C=C\CNC(C)C
SPLASH splash10-052b-9000000000-565fe88fa4b4b65432e3
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.
Sample Preparation Procedure Detected: U
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_2933