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4-(3,3-dimethyl-1-oxo-10-propionyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl)benzonitrile
SpectraBase Compound ID CEqiJj8SGGC
InChI InChI=1S/C25H25N3O2/c1-4-22(30)28-20-8-6-5-7-18(20)27-19-13-25(2,3)14-21(29)23(19)24(28)17-11-9-16(15-26)10-12-17/h5-12,24,27H,4,13-14H2,1-3H3
InChIKey FQTVQAFAUZNTAR-UHFFFAOYSA-N
Mol Weight 399.49 g/mol
Molecular Formula C25H25N3O2
Exact Mass 399.194677 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HDopVndhnuc
Name 4-(3,3-dimethyl-1-oxo-10-propionyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl)benzonitrile
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C25H25N3O2/c1-4-22(30)28-20-8-6-5-7-18(20)27-19-13-25(2,3)14-21(29)23(19)24(28)17-11-9-16(15-26)10-12-17/h5-12,24,27H,4,13-14H2,1-3H3
InChIKey FQTVQAFAUZNTAR-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_16529
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: UZI/8132278; UBI_ID: UBI-016532
Temperature 308 °C