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Metoprolol -H2O AC
SpectraBase Compound ID B7ZI0vFAH6b
InChI InChI=1S/C17H25NO3/c1-4-11-18(15(2)19)12-5-13-21-17-8-6-16(7-9-17)10-14-20-3/h5-9,13H,4,10-12,14H2,1-3H3/b13-5-
InChIKey YWZXQACTDAUVOL-ACAGNQJTSA-N
Mol Weight 291.39 g/mol
Molecular Formula C17H25NO3
Exact Mass 291.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ksv8HPFUhgp
Name Metoprolol -H2O AC
Classification Beta-Blocker
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Exact Mass 291.183443666 u
Formula C17H25NO3
InChI InChI=1S/C17H25NO3/c1-4-11-18(15(2)19)12-5-13-21-17-8-6-16(7-9-17)10-14-20-3/h5-9,13H,4,10-12,14H2,1-3H3/b13-5-
InChIKey YWZXQACTDAUVOL-ACAGNQJTSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 291.391 g/mol
SMILES c1cc(CCOC)ccc1O\C=C/CN(CCC)C(C)=O
SPLASH splash10-052p-6920000000-61b7276d172f7ecf6838
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+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_1134