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Alprenolol 2AC
SpectraBase Compound ID Bq4wDmAwry9
InChI InChI=1S/C19H27NO4/c1-6-9-17-10-7-8-11-19(17)23-13-18(24-16(5)22)12-20(14(2)3)15(4)21/h6-8,10-11,14,18H,1,9,12-13H2,2-5H3
InChIKey JULCEMKDOVJFID-UHFFFAOYSA-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 DwBDgHUtTdL
Name Alprenolol 2AC
Classification Beta-Blocker
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Exact Mass 333.194008349 u
Formula C19H27NO4
InChI InChI=1S/C19H27NO4/c1-6-9-17-10-7-8-11-19(17)23-13-18(24-16(5)22)12-20(14(2)3)15(4)21/h6-8,10-11,14,18H,1,9,12-13H2,2-5H3
InChIKey JULCEMKDOVJFID-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 333.428 g/mol
SMILES c1c(OCC(OC(=O)C)CN(C(C)C)C(C)=O)c(CC=C)ccc1
SPLASH splash10-0udi-9780000000-35d71e92b8b1e9fcaefa
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: UHYAC
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_1575