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5-(3-Chlorobenzyl)-5H-dibenzo[b,e]azepine-6,11-dione
SpectraBase Compound ID G3n4h7tGyau
InChI InChI=1S/C21H14ClNO2/c22-15-7-5-6-14(12-15)13-23-19-11-4-3-10-18(19)20(24)16-8-1-2-9-17(16)21(23)25/h1-12H,13H2
InChIKey KKEYRBWSHUSBHY-UHFFFAOYSA-N
Mol Weight 347.8 g/mol
Molecular Formula C21H14ClNO2
Exact Mass 347.071306 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzNASKk4K1o
Name 5-(3-Chlorobenzyl)-5H-dibenzo[b,e]azepine-6,11-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H14ClNO2
InChI InChI=1S/C21H14ClNO2/c22-15-7-5-6-14(12-15)13-23-19-11-4-3-10-18(19)20(24)16-8-1-2-9-17(16)21(23)25/h1-12H,13H2
InChIKey KKEYRBWSHUSBHY-UHFFFAOYSA-N
Literature Reference DOI 10.1039/C6QO00036C
Molecular Weight 347.801 g/mol
SMILES c12N(C(c3c(C(c2cccc1)=O)cccc3)=O)Cc1cc(ccc1)Cl
SPLASH splash10-0002-0019000000-ec57976cb5c7bd686f55
Source of Spectrum OCF-3-614/SM10-7l
Wiley ID 1804830