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Betaxolol-M -H2O 2AC
SpectraBase Compound ID DuemvEowcXD
InChI InChI=1S/C18H25NO4/c1-14(2)19(15(3)20)11-5-12-23-18-8-6-17(7-9-18)10-13-22-16(4)21/h5-9,11,14H,10,12-13H2,1-4H3/b11-5-
InChIKey VNGUHMDNAOOLBY-WZUFQYTHSA-N
Mol Weight 319.4 g/mol
Molecular Formula C18H25NO4
Exact Mass 319.178358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4N7C603TvM
Name Betaxolol-M -H2O 2AC
Classification Beta-Blocker
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Exact Mass 319.178358285 u
Formula C18H25NO4
InChI InChI=1S/C18H25NO4/c1-14(2)19(15(3)20)11-5-12-23-18-8-6-17(7-9-18)10-13-22-16(4)21/h5-9,11,14H,10,12-13H2,1-4H3/b11-5-
InChIKey VNGUHMDNAOOLBY-WZUFQYTHSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 319.401 g/mol
SMILES c1c(ccc(CCOC(C)=O)c1)OC\C=C/N(C(=O)C)C(C)C
SPLASH splash10-066v-9841000000-c76578bbf4da15a0efcf
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
Synonyms Betaxolol-M (O-dealkyl-) -H2O 2AC
Technique GC/MS
Wiley ID MMPW6e_1584