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Clomipramine-M (nor-) TFA
SpectraBase Compound ID IG88sTvECQM
InChI InChI=1S/C20H20ClF3N2O/c1-25(19(27)20(22,23)24)11-4-12-26-17-6-3-2-5-14(17)7-8-15-9-10-16(21)13-18(15)26/h2-3,5-6,9-10,13H,4,7-8,11-12H2,1H3
InChIKey NBOJXMMWVSXSGL-UHFFFAOYSA-N
Mol Weight 396.84 g/mol
Molecular Formula C20H20ClF3N2O
Exact Mass 396.121625 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1LB3jwbKN6
Name Clomipramine-M (nor-) TFA
Classification Antidepressant
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Exact Mass 396.121625460 u
Formula C20H20ClN2OF3
InChI InChI=1S/C20H20ClF3N2O/c1-25(19(27)20(22,23)24)11-4-12-26-17-6-3-2-5-14(17)7-8-15-9-10-16(21)13-18(15)26/h2-3,5-6,9-10,13H,4,7-8,11-12H2,1H3
InChIKey NBOJXMMWVSXSGL-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 396.841 g/mol
SMILES c12CCc3ccc(Cl)cc3N(CCCN(C)C(C(F)(F)F)=O)c2cccc1
SPLASH splash10-0006-4790000000-51af2cc792f0fafbe92d
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_7664