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9-(4-fluorophenyl)-6-(2-thienyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
SpectraBase Compound ID DqMEJfLrZen
InChI InChI=1S/C23H19FN2OS/c24-16-9-7-14(8-10-16)15-12-19-22(20(27)13-15)23(21-6-3-11-28-21)26-18-5-2-1-4-17(18)25-19/h1-11,15,23,25-26H,12-13H2
InChIKey YJMNXFXVEFSOHT-UHFFFAOYSA-N
Mol Weight 390.48 g/mol
Molecular Formula C23H19FN2OS
Exact Mass 390.120213 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID WpeyNDj7kU
Name 9-(4-fluorophenyl)-6-(2-thienyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H19FN2OS
InChI InChI=1S/C23H19FN2OS/c24-16-9-7-14(8-10-16)15-12-19-22(20(27)13-15)23(21-6-3-11-28-21)26-18-5-2-1-4-17(18)25-19/h1-11,15,23,25-26H,12-13H2
InChIKey YJMNXFXVEFSOHT-UHFFFAOYSA-N
Molecular Weight 390.476 g/mol
SMILES N1c2ccccc2NC(C2=C1CC(CC2=O)c1ccc(cc1)F)c1sccc1
SPLASH splash10-0ap3-5975000000-8f319b91d6fe4e9701ae
Synonyms 9-(4-fluorophenyl)-6-thiophen-2-yl-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
Wiley ID 1453156