N-Desmethylclomipramine

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Systematic / IUPAC Name: 3-(3-Chloro-10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-N-methyl-1-propanamine

ID: Reference831

Other Names: Desmethylclomipramine;
Demethylchlorimipramine;
Desmethylchlorimipramine;
3-Chloro-10,11-dihydro-N-methyl-5H-dibenz(b,f)azepine-5-propanamine;
5H-Dibenz(b,f)azepine-5-propanamine, 3-chloro-10,11-dihydro-N-methyl-

Formula: C18H21ClN2

Class: Therapeutics/Prescription Drugs Sports Doping Drugs

Spectral Data

N-Desmethylclomipramine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap; Q Exactive Plus Orbitrap
No. of Spectral Trees 3
No. of Spectra 293
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 12/3/2018 8:50:57 AM
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Identificators

InChI InChI=1S/C18H21ClN2/c1-20-11-4-12-21-17-6-3-2-5-14(17)7-8-15-9-10-16(19)13-18(15)21/h2-3,5-6,9-10,13,20H,4,7-8,11-12H2,1H3
InChI Key VPIXQGUBUKFLRF-UHFFFAOYSA-N
Canonical SMILES
CAS 303480
Splash
Other Names Desmethylclomipramine;
Demethylchlorimipramine;
Desmethylchlorimipramine;
3-Chloro-10,11-dihydro-N-methyl-5H-dibenz(b,f)azepine-5-propanamine;
5H-Dibenz(b,f)azepine-5-propanamine, 3-chloro-10,11-dihydro-N-methyl-;
Norclomipramine

In Other Databases

HMDb HMDB60947
PubChem 622606
ChemSpider 540947
ChemIDPlus 000303480
Cayman 19034