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Brofaromine AC
SpectraBase Compound ID K3k9MF7ot2R
InChI InChI=1S/C16H18BrNO3/c1-10(19)18-5-3-11(4-6-18)14-9-13-15(20-2)7-12(17)8-16(13)21-14/h7-9,11H,3-6H2,1-2H3
InChIKey BGKKVRSSDRYGLX-UHFFFAOYSA-N
Mol Weight 352.23 g/mol
Molecular Formula C16H18BrNO3
Exact Mass 351.047006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6vqEVcER2Rq
Name Brofaromine AC
Classification MAO-Inhibitor
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Exact Mass 351.047006441 u
Formula C16H18BrNO3
InChI InChI=1S/C16H18BrNO3/c1-10(19)18-5-3-11(4-6-18)14-9-13-15(20-2)7-12(17)8-16(13)21-14/h7-9,11H,3-6H2,1-2H3
InChIKey BGKKVRSSDRYGLX-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 352.228 g/mol
Related CAS Registry Number(s) 63638-91-5
SMILES c1(C2CCN(CC2)C(C)=O)oc2c(c(OC)cc(Br)c2)c1
SPLASH splash10-0pb9-9456000000-53e2fb5bc994430c6877
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
Technique GC/MS
Wiley ID MMPW6e_2405