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Benzenemethanol, 4-hydroxy-.alpha.-[1-[(1-methyl-3-phenylpropyl)amino]ethyl]-
SpectraBase Compound ID DyeEidjzUb1
InChI InChI=1S/C19H25NO2/c1-14(8-9-16-6-4-3-5-7-16)20-15(2)19(22)17-10-12-18(21)13-11-17/h3-7,10-15,19-22H,8-9H2,1-2H3
InChIKey PTGXAUBQBSGPKF-UHFFFAOYSA-N
Mol Weight 299.41 g/mol
Molecular Formula C19H25NO2
Exact Mass 299.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3RnDSXe2KG
Name Buphenine
CAS Registry Number 447-41-6
Classification Vasodilator
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Exact Mass 299.188529047 u
Formula C19H25NO2
InChI InChI=1S/C19H25NO2/c1-14(8-9-16-6-4-3-5-7-16)20-15(2)19(22)17-10-12-18(21)13-11-17/h3-7,10-15,19-22H,8-9H2,1-2H3
InChIKey PTGXAUBQBSGPKF-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 299.414 g/mol
SMILES CC(C(c1ccc(cc1)O)O)NC(C)CCc1ccccc1
SPLASH splash10-00bc-9600000000-6e982a2a13083ec07588
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_1409