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Befunolol -H2O AC
SpectraBase Compound ID 8RTxllQpdI9
InChI InChI=1S/C18H21NO4/c1-12(2)19(14(4)21)9-6-10-22-16-8-5-7-15-11-17(13(3)20)23-18(15)16/h5-9,11-12H,10H2,1-4H3/b9-6+
InChIKey JGEGGWOUYMIXAT-RMKNXTFCSA-N
Mol Weight 315.37 g/mol
Molecular Formula C18H21NO4
Exact Mass 315.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1modmlp1HHF
Name Befunolol -H2O AC
Classification Beta-Blocker
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Exact Mass 315.147058156 u
Formula C18H21NO4
InChI InChI=1S/C18H21NO4/c1-12(2)19(14(4)21)9-6-10-22-16-8-5-7-15-11-17(13(3)20)23-18(15)16/h5-9,11-12H,10H2,1-4H3/b9-6+
InChIKey JGEGGWOUYMIXAT-RMKNXTFCSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 315.369 g/mol
SMILES c1(oc2c(OC\C=C\N(C(C)C)C(C)=O)cccc2c1)C(=O)C
SPLASH splash10-0a4j-9410000000-e73737352d6fcbb5e083
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_2427