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Nomifensine-M (HO-) isomer-1 2AC
SpectraBase Compound ID 5042ZmzkkPI
InChI InChI=1S/C20H22N2O3/c1-13(23)21-20-6-4-5-17-18(11-22(3)12-19(17)20)15-7-9-16(10-8-15)25-14(2)24/h4-10,18H,11-12H2,1-3H3,(H,21,23)
InChIKey ONEINIHLXNGMAA-UHFFFAOYSA-N
Mol Weight 338.41 g/mol
Molecular Formula C20H22N2O3
Exact Mass 338.163043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 75JTHIbvfUz
Name Nomifensine-M (HO-) isomer-2 2AC
Classification Antidepressant
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 338.163042573 u
Formula C20H22N2O3
InChI InChI=1S/C20H22N2O3/c1-13(23)21-20-6-4-5-17-18(11-22(3)12-19(17)20)15-7-9-16(10-8-15)25-14(2)24/h4-10,18H,11-12H2,1-3H3,(H,21,23)
InChIKey ONEINIHLXNGMAA-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 338.407 g/mol
SMILES c12c(cccc1C(CN(C2)C)c1ccc(cc1)OC(C)=O)NC(=O)C
SPLASH splash10-00lu-0592000000-f71d6e06df75b3f464d2
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_364