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1H-dibenzo[b,e][1,4]diazepin-1-one, 2,3,4,5,10,11-hexahydro-11-[4-(methylthio)phenyl]-3-(2-thienyl)-
SpectraBase Compound ID 6CHtVGbPAaA
InChI InChI=1S/C24H22N2OS2/c1-28-17-10-8-15(9-11-17)24-23-20(25-18-5-2-3-6-19(18)26-24)13-16(14-21(23)27)22-7-4-12-29-22/h2-12,16,24-26H,13-14H2,1H3
InChIKey BZJSVJDFBWBYBZ-UHFFFAOYSA-N
Mol Weight 418.57 g/mol
Molecular Formula C24H22N2OS2
Exact Mass 418.117356 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LnpVbjUMj6t
Name 1H-dibenzo[b,e][1,4]diazepin-1-one, 2,3,4,5,10,11-hexahydro-11-[4-(methylthio)phenyl]-3-(2-thienyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 418.117355683 u
Formula C24H22N2OS2
InChI InChI=1S/C24H22N2OS2/c1-28-17-10-8-15(9-11-17)24-23-20(25-18-5-2-3-6-19(18)26-24)13-16(14-21(23)27)22-7-4-12-29-22/h2-12,16,24-26H,13-14H2,1H3
InChIKey BZJSVJDFBWBYBZ-UHFFFAOYSA-N
Molecular Weight 418.573 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_18447
Solvent DMSO-d6
Source Vendor ID: NMR/11270786; Lab Info: SAS; Lab Number: SAS-tst5096