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Desmethylclomipramine
SpectraBase Compound ID DMkBoQPj0ev
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
InChIKey VPIXQGUBUKFLRF-UHFFFAOYSA-N
Mol Weight 300.83 g/mol
Molecular Formula C18H21ClN2
Exact Mass 300.139326 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID utXVdbQMQr
Name 3-(3-Chloro-10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-N-methyl-1-propanamine
CAS Registry Number 303-48-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21ClN2
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
InChIKey VPIXQGUBUKFLRF-UHFFFAOYSA-N
Molecular Weight 300.833 g/mol
SMILES N(CCCN1c2c(CCc3c1cccc3)ccc(c2)Cl)C
SPLASH splash10-016u-2390000000-3e91468f669ebf2eb91a
Synonyms 3-(2-Chloranyl-5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N-methyl-propan-1-amine 3-(2-Chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N-methyl-1-propanamine 3-(2-Chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N-methyl-propan-1-amine 3-(2-Chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl-methyl-amine 3-Chloro-10,11-dihydro-N-methyl-5H-dibenz(b,f)azepine-5-propanamine Demethylchlorimipramine Desmethylchlorimipramine Desmethylclomipramine N-Demethylclomipramine
Wiley ID 1509092