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Propafenone-M (HO-) -H2O
SpectraBase Compound ID KrtjKfSEiff
InChI InChI=1S/C21H25NO3/c1-2-13-22-14-6-15-25-21-12-10-18(23)16-19(21)20(24)11-9-17-7-4-3-5-8-17/h3-8,10,12,14,16,22-23H,2,9,11,13,15H2,1H3/b14-6+
InChIKey KYMQAJLIYWNHSC-MKMNVTDBSA-N
Mol Weight 339.44 g/mol
Molecular Formula C21H25NO3
Exact Mass 339.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H0jsaPA4tle
Name Propafenone-M (HO-) -H2O
Classification Antiarrhythmic
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 339.183443666 u
Formula C21H25NO3
InChI InChI=1S/C21H25NO3/c1-2-13-22-14-6-15-25-21-12-10-18(23)16-19(21)20(24)11-9-17-7-4-3-5-8-17/h3-8,10,12,14,16,22-23H,2,9,11,13,15H2,1H3/b14-6+
InChIKey KYMQAJLIYWNHSC-MKMNVTDBSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 339.435 g/mol
SMILES c1c(c(cc(c1)O)C(=O)CCc1ccccc1)OC\C=C\NCCC
SPLASH splash10-006w-9831000000-9ac12355a6bc7fce0f4e
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
Technique GC/MS
Wiley ID MMPW6e_898