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Acebutolol HY                 @
SpectraBase Compound ID 3B5GV8NU0WS
InChI InChI=1S/C14H22N2O3/c1-9(2)16-7-12(18)8-19-14-5-4-11(15)6-13(14)10(3)17/h4-6,9,12,16,18H,7-8,15H2,1-3H3
InChIKey DBUJVRULIBQHKT-UHFFFAOYSA-N
Mol Weight 266.34 g/mol
Molecular Formula C14H22N2O3
Exact Mass 266.163043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CMziXQLB3SM
Name Acebutolol HY @
Classification Beta-Blocker
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Exact Mass 266.163042573 u
Formula C14H22N2O3
InChI InChI=1S/C14H22N2O3/c1-9(2)16-7-12(18)8-19-14-5-4-11(15)6-13(14)10(3)17/h4-6,9,12,16,18H,7-8,15H2,1-3H3
InChIKey DBUJVRULIBQHKT-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 266.341 g/mol
SMILES c1c(c(C(C)=O)cc(N)c1)OCC(O)CNC(C)C
SPLASH splash10-0uk9-8900000000-dd7031d8ace86ffca43e
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: UHY
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Diacetolol HY
Technique GC/MS
Wiley ID MMPW6e_1567