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Clomipramine-M (HO-ring) AC
SpectraBase Compound ID C2mu5wZDZMD
InChI InChI=1S/C16H14ClNO2/c1-10(19)20-14-7-5-12-3-2-11-4-6-13(17)8-15(11)18-16(12)9-14/h4-9,18H,2-3H2,1H3
InChIKey HBZUTXACJUPDIW-UHFFFAOYSA-N
Mol Weight 287.75 g/mol
Molecular Formula C16H14ClNO2
Exact Mass 287.071306 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FcaNWFSGi6q
Name Clomipramine-M (HO-ring) AC
Classification Antidepressant
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 287.071306393 u
Formula C16H14ClNO2
InChI InChI=1S/C16H14ClNO2/c1-10(19)20-14-7-5-12-3-2-11-4-6-13(17)8-15(11)18-16(12)9-14/h4-9,18H,2-3H2,1H3
InChIKey HBZUTXACJUPDIW-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 287.746 g/mol
SMILES CC(Oc1cc2Nc3cc(Cl)ccc3CCc2cc1)=O
SPLASH splash10-0002-1290000000-e4d1cbde3abb33dd0f05
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_4159