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4-(4-Bromo-phenyl)-1,3-diphenyl-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-one
SpectraBase Compound ID 6BYAy9f1301
InChI InChI=1S/C24H18BrN3OS/c25-18-13-11-17(12-14-18)23-21-22(16-7-3-1-4-8-16)27-28(19-9-5-2-6-10-19)24(21)26-20(29)15-30-23/h1-14,23H,15H2,(H,26,29)
InChIKey FSXKFHPMXBPGKE-UHFFFAOYSA-N
Mol Weight 476.39 g/mol
Molecular Formula C24H18BrN3OS
Exact Mass 475.035396 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BmU1OPk6YNK
Name 1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one, 4-(4-bromophenyl)-4,8-dihydro-1,3-diphenyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 475.035396385 u
Formula C24H18BrN3OS
InChI InChI=1S/C24H18BrN3OS/c25-18-13-11-17(12-14-18)23-21-22(16-7-3-1-4-8-16)27-28(19-9-5-2-6-10-19)24(21)26-20(29)15-30-23/h1-14,23H,15H2,(H,26,29)
InChIKey FSXKFHPMXBPGKE-UHFFFAOYSA-N
Molecular Weight 476.392 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15735
Solvent DMSO-d6
Source Vendor ID: NMR/11220502; Lab Info: AMI; Lab Number: 464