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3-pyrrolidinecarboxamide, N-(2-benzothiazolyl)-1-(4-bromophenyl)-5-oxo-
SpectraBase Compound ID Em4GAlYSTED
InChI InChI=1S/C18H14BrN3O2S/c19-12-5-7-13(8-6-12)22-10-11(9-16(22)23)17(24)21-18-20-14-3-1-2-4-15(14)25-18/h1-8,11H,9-10H2,(H,20,21,24)
InChIKey AGLPRANUXCSKTJ-UHFFFAOYSA-N
Mol Weight 416.29 g/mol
Molecular Formula C18H14BrN3O2S
Exact Mass 414.999011 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4IjqAHRFJbL
Name 3-pyrrolidinecarboxamide, N-(2-benzothiazolyl)-1-(4-bromophenyl)-5-oxo-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 414.999010875 u
Formula C18H14BrN3O2S
InChI InChI=1S/C18H14BrN3O2S/c19-12-5-7-13(8-6-12)22-10-11(9-16(22)23)17(24)21-18-20-14-3-1-2-4-15(14)25-18/h1-8,11H,9-10H2,(H,20,21,24)
InChIKey AGLPRANUXCSKTJ-UHFFFAOYSA-N
Molecular Weight 416.293 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8922
Solvent DMSO-d6
Source Vendor ID: NMR/9291266; Lab Info: LP; Lab Number: LP-0200189