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11-(1,3-Benzodioxol-5-yl)-3-phenyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
SpectraBase Compound ID y4mtujEH5U
InChI InChI=1S/C26H22N2O3/c29-22-13-18(16-6-2-1-3-7-16)12-21-25(22)26(28-20-9-5-4-8-19(20)27-21)17-10-11-23-24(14-17)31-15-30-23/h1-11,14,18,26-28H,12-13,15H2
InChIKey YSGTYGQEFBNJAA-UHFFFAOYSA-N
Mol Weight 410.47 g/mol
Molecular Formula C26H22N2O3
Exact Mass 410.163043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8r1a1woLF2J
Name 11-(1,3-Benzodioxol-5-yl)-3-phenyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H22N2O3
InChI InChI=1S/C26H22N2O3/c29-22-13-18(16-6-2-1-3-7-16)12-21-25(22)26(28-20-9-5-4-8-19(20)27-21)17-10-11-23-24(14-17)31-15-30-23/h1-11,14,18,26-28H,12-13,15H2
InChIKey YSGTYGQEFBNJAA-UHFFFAOYSA-N
Molecular Weight 410.473 g/mol
SMILES N1c2ccccc2NC(C2=C1CC(CC2=O)c1ccccc1)c1cc2OCOc2cc1
SPLASH splash10-000l-8950000000-a7259041e9a0728999b0
Synonyms 6-(1,3-benzodioxol-5-yl)-9-phenyl-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
Wiley ID 1446695