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Befunolol-A (CH2O,-H2O)
SpectraBase Compound ID F2B2Tycuq8m
InChI InChI=1S/C17H21NO4/c1-11(2)18-8-14(21-10-18)9-20-15-6-4-5-13-7-16(12(3)19)22-17(13)15/h4-7,11,14H,8-10H2,1-3H3
InChIKey KIXSVMQGCQWEJQ-UHFFFAOYSA-N
Mol Weight 303.36 g/mol
Molecular Formula C17H21NO4
Exact Mass 303.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KDJwoNMy1DH
Name Befunolol formyl artifact
Classification Beta-Blocker
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Exact Mass 303.147058156 u
Formula C17H21NO4
InChI InChI=1S/C17H21NO4/c1-11(2)18-8-14(21-10-18)9-20-15-6-4-5-13-7-16(12(3)19)22-17(13)15/h4-7,11,14H,8-10H2,1-3H3
InChIKey KIXSVMQGCQWEJQ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 303.358 g/mol
SMILES c1(oc2c(cccc2OCC2CN(CO2)C(C)C)c1)C(C)=O
SPLASH splash10-00di-9110000000-25920ccd30f07d7afea4
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_2401