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Imipramine N-Oxide-[d6] monohydrate

General Information
Catalog: BLP-013728
CAS: 1216808-01-3
Molecular Formula: C19H20D6N2O2
Molecular Weight: 320.46
Chemical Structure
Imipramine N-Oxide-[d6] monohydrate
Description Imipramine N-Oxide-[d6] monohydrate is the labelled analogue of Imipramine N-Oxide monohydrate, which is a metabolite of Imipramine.
Synonyms Imipramine N-Oxide-d6 monohydrate; 10,11-Dihydro-N,N-(dimethyl-d6)-5H-dibenz[b,f]azepine-5-propanamine N-Oxide Monohydrate; 5-[3-(Dimethylamino-d6)propyl]-10,11-dihydro-5H-dibenz[b,f]azepine 5-oxide Monohydrate; Imipraminoxide-d6 Monohydrate
IUPAC Name 3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N-bis(trideuteriomethyl)propan-1-amine oxide;hydrate
Related CAS 1215681-42-7 (unlabelled) 6829-98-7 (unlabelled free base)
Canonical SMILES C[N+](C)(CCCN1C2=CC=CC=C2CCC3=CC=CC=C31)[O-].O
InChI InChI=1S/C19H24N2O.H2O/c1-21(2,22)15-7-14-20-18-10-5-3-8-16(18)12-13-17-9-4-6-11-19(17)20;/h3-6,8-11H,7,12-15H2,1-2H3;1H2/i1D3,2D3;
InChI Key RQXNUQYIRZIYMU-TXHXQZCNSA-N
Melting Point 93-95°C
Solubility Soluble in Acetone, Benzene, Ether, Methanol
Appearance White Crystalline Solid

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