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1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-(4-piperonylpiperazino)ethanone
SpectraBase Compound ID Gu0X2Pxgg69
InChI InChI=1S/C28H29N3O3/c32-28(31-24-7-3-1-5-22(24)10-11-23-6-2-4-8-25(23)31)19-30-15-13-29(14-16-30)18-21-9-12-26-27(17-21)34-20-33-26/h1-9,12,17H,10-11,13-16,18-20H2
InChIKey OYANWEQMFTUOGS-UHFFFAOYSA-N
Mol Weight 455.56 g/mol
Molecular Formula C28H29N3O3
Exact Mass 455.220892 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5btOQfRGHfR
Name 1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-(4-piperonylpiperazino)ethanone
Alternate Name(s) 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)ethanone 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H29N3O3
InChI InChI=1S/C28H29N3O3/c32-28(31-24-7-3-1-5-22(24)10-11-23-6-2-4-8-25(23)31)19-30-15-13-29(14-16-30)18-21-9-12-26-27(17-21)34-20-33-26/h1-9,12,17H,10-11,13-16,18-20H2
InChIKey OYANWEQMFTUOGS-UHFFFAOYSA-N
Molecular Weight 455.558 g/mol
SMILES c1ccc2N(C(CN3CCN(CC3)Cc3cc4OCOc4cc3)=O)c3c(CCc2c1)cccc3
SPLASH splash10-000i-8940000000-18c52311ab2ff111e180
Wiley ID 1442621