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Clomipramine-M (nor-) HFB
SpectraBase Compound ID 14cGyRAFG1Z
InChI InChI=1S/C22H20ClF7N2O/c1-31(19(33)20(24,25)21(26,27)22(28,29)30)11-4-12-32-17-6-3-2-5-14(17)7-8-15-9-10-16(23)13-18(15)32/h2-3,5-6,9-10,13H,4,7-8,11-12H2,1H3
InChIKey GHXOBWKVIDWTHI-UHFFFAOYSA-N
Mol Weight 496.86 g/mol
Molecular Formula C22H20ClF7N2O
Exact Mass 496.115238 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IOrtdjYTCK0
Name Clomipramine-M (nor-) HFB
Classification Antidepressant
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Exact Mass 496.115238112 u
Formula C22H20ClN2OF7
InChI InChI=1S/C22H20ClF7N2O/c1-31(19(33)20(24,25)21(26,27)22(28,29)30)11-4-12-32-17-6-3-2-5-14(17)7-8-15-9-10-16(23)13-18(15)32/h2-3,5-6,9-10,13H,4,7-8,11-12H2,1H3
InChIKey GHXOBWKVIDWTHI-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 496.857 g/mol
SMILES c12CCc3c(N(CCCN(C)C(C(F)(F)C(F)(F)C(F)(F)F)=O)c1cccc2)cc(Cl)cc3
SPLASH splash10-00mo-4590100000-15514f5d210a426c5304
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_7666