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2-furancarboxamide, 5-[(4-bromo-1H-pyrazol-1-yl)methyl]-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl)-
SpectraBase Compound ID BRpSjHxFWAX
InChI InChI=1S/C19H17BrN4O2S/c20-12-9-22-24(10-12)11-13-6-7-16(26-13)18(25)23-19-15(8-21)14-4-2-1-3-5-17(14)27-19/h6-7,9-10H,1-5,11H2,(H,23,25)
InChIKey LCERXWIRJHYLSX-UHFFFAOYSA-N
Mol Weight 445.34 g/mol
Molecular Formula C19H17BrN4O2S
Exact Mass 444.02556 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EjH5kIekXrR
Name 2-furancarboxamide, 5-[(4-bromo-1H-pyrazol-1-yl)methyl]-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 444.025559975 u
Formula C19H17BrN4O2S
InChI InChI=1S/C19H17BrN4O2S/c20-12-9-22-24(10-12)11-13-6-7-16(26-13)18(25)23-19-15(8-21)14-4-2-1-3-5-17(14)27-19/h6-7,9-10H,1-5,11H2,(H,23,25)
InChIKey LCERXWIRJHYLSX-UHFFFAOYSA-N
Molecular Weight 445.335 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_1278
Solvent DMSO-d6
Source Vendor ID: NMR/13239989