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(5H-Dibenzo[b,f]azepin-5-yl)(4-(3-methoxyphenyl)piperazin-1-yl)methanone
SpectraBase Compound ID 7ledooabGDA
InChI InChI=1S/C26H25N3O2/c1-31-23-10-6-9-22(19-23)27-15-17-28(18-16-27)26(30)29-24-11-4-2-7-20(24)13-14-21-8-3-5-12-25(21)29/h2-14,19H,15-18H2,1H3
InChIKey OXVNKCOXCSBZEG-UHFFFAOYSA-N
Mol Weight 411.51 g/mol
Molecular Formula C26H25N3O2
Exact Mass 411.194677 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2x3CFjhDQhq
Name (5H-Dibenzo[b,f]azepin-5-yl)(4-(3-methoxyphenyl)piperazin-1-yl)methanone
Appearance White powder
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Formula C26H25N3O2
InChI InChI=1S/C26H25N3O2/c1-31-23-10-6-9-22(19-23)27-15-17-28(18-16-27)26(30)29-24-11-4-2-7-20(24)13-14-21-8-3-5-12-25(21)29/h2-14,19H,15-18H2,1H3
InChIKey OXVNKCOXCSBZEG-UHFFFAOYSA-N
Instrument Name Finnigan MAT GCQ
Ionization Type EI
Literature Reference DOI 10.1021/acs.jmedchem.6b01591
Molecular Weight 411.505 g/mol
SMILES C(N1c2ccccc2C=Cc2ccccc12)(N1CCN(c2cccc(OC)c2)CC1)=O
SPLASH splash10-0006-0920100000-ce5fcfeefc099fd2beff
Source of Spectrum AF-60-762-17b
Wiley ID 1865584