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Metipranolol -H2O AC
SpectraBase Compound ID KEbxZ5dbVDM
InChI InChI=1S/C19H27NO4/c1-12(2)20(16(6)21)9-8-10-23-19-13(3)11-18(24-17(7)22)14(4)15(19)5/h8-9,11-12H,10H2,1-7H3/b9-8+
InChIKey KVSFFSCCCNVEHN-CMDGGOBGSA-N
Mol Weight 333.43 g/mol
Molecular Formula C19H27NO4
Exact Mass 333.194008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1QahcwMie3o
Name Metipranolol -H2O AC
Classification Beta-Blocker
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Exact Mass 333.194008349 u
Formula C19H27NO4
InChI InChI=1S/C19H27NO4/c1-12(2)20(16(6)21)9-8-10-23-19-13(3)11-18(24-17(7)22)14(4)15(19)5/h8-9,11-12H,10H2,1-7H3/b9-8+
InChIKey KVSFFSCCCNVEHN-CMDGGOBGSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 333.428 g/mol
SMILES c1(c(OC\C=C\N(C(=O)C)C(C)C)c(c(C)c(OC(C)=O)c1)C)C
SPLASH splash10-0007-4920000000-be0df19250378e14d01e
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_1388