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(2-Phenyl (1H-benzo[b]-1,4-diazepin-3-yl))-N-{4-[(2-phenyl)(1H-benzo[b]-1,4-diazepin-3-yl)-carbo-nylamino-]-phenyl}-carboxamide

View entire compound with spectra: 1 MS (GC)

(2-Phenyl (1H-benzo[b]-1,4-diazepin-3-yl))-N-{4-[(2-phenyl)(1H-benzo[b]-1,4-diazepin-3-yl)-carbo-nylamino-]-phenyl}-carboxamide
SpectraBase Compound ID DckYTEML3l2
InChI InChI=1S/C38H28N6O2/c45-37(29-23-39-31-15-7-9-17-33(31)43-35(29)25-11-3-1-4-12-25)41-27-19-21-28(22-20-27)42-38(46)30-24-40-32-16-8-10-18-34(32)44-36(30)26-13-5-2-6-14-26/h1-24,43-44H,(H,41,45)(H,42,46)
InChIKey IXWLKKFSUFMTPE-UHFFFAOYSA-N
Mol Weight 600.7 g/mol
Molecular Formula C38H28N6O2
Exact Mass 600.227374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fn5Lz6iLqk8
Name (2-Phenyl (1H-benzo[b]-1,4-diazepin-3-yl))-N-{4-[(2-phenyl)(1H-benzo[b]-1,4-diazepin-3-yl)-carbo-nylamino-]-phenyl}-carboxamide
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H28N6O2
InChI InChI=1S/C38H28N6O2/c45-37(29-23-39-31-15-7-9-17-33(31)43-35(29)25-11-3-1-4-12-25)41-27-19-21-28(22-20-27)42-38(46)30-24-40-32-16-8-10-18-34(32)44-36(30)26-13-5-2-6-14-26/h1-24,43-44H,(H,41,45)(H,42,46)
InChIKey IXWLKKFSUFMTPE-UHFFFAOYSA-N
Molecular Weight 600.682 g/mol
SMILES N1c2ccccc2N=CC(C(Nc2ccc(NC(C3=C(Nc4ccccc4N=C3)c3ccccc3)=O)cc2)=O)=C1c1ccccc1
SPLASH splash10-0udi-0000009000-44f0db1adc4dbe0e7789
Source of Spectrum Y-49-386-20
Wiley ID 1706545