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Desipramine-M (di-HO-ring) 2AC       @
SpectraBase Compound ID 3Ju9TUuSeNS
InChI InChI=1S/C18H17NO4/c1-11(20)22-17-9-14-8-7-13-5-3-4-6-15(13)19-16(14)10-18(17)23-12(2)21/h3-6,9-10,19H,7-8H2,1-2H3
InChIKey KPFDCRURXFUYFF-UHFFFAOYSA-N
Mol Weight 311.34 g/mol
Molecular Formula C18H17NO4
Exact Mass 311.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ad09OGH9k
Name Desipramine-M (di-HO-ring) 2AC @
Classification Antidepressant
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 311.115758027 u
Formula C18H17NO4
InChI InChI=1S/C18H17NO4/c1-11(20)22-17-9-14-8-7-13-5-3-4-6-15(13)19-16(14)10-18(17)23-12(2)21/h3-6,9-10,19H,7-8H2,1-2H3
InChIKey KPFDCRURXFUYFF-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 311.337 g/mol
SMILES CC(Oc1c(cc2c(CCc3c(cccc3)N2)c1)OC(=O)C)=O
SPLASH splash10-004i-1491000000-9902025af41ea21df21a
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: U+UHYAC
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Imipramine-M (di-HO-ring) 2AC Lofepramine-M (di-HO-ring) 2AC Trimipramine-M (di-HO-ring) 2AC
Technique GC/MS
Wiley ID MMPW6e_2292