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1H-pyrazole-5-carboxamide, N-(5-bromo-2-pyridinyl)-3-nitro-1-(phenylmethyl)-
SpectraBase Compound ID C8N9YcuSKFD
InChI InChI=1S/C16H12BrN5O3/c17-12-6-7-14(18-9-12)19-16(23)13-8-15(22(24)25)20-21(13)10-11-4-2-1-3-5-11/h1-9H,10H2,(H,18,19,23)
InChIKey IDJQVSKCPSVNHM-UHFFFAOYSA-N
Mol Weight 402.21 g/mol
Molecular Formula C16H12BrN5O3
Exact Mass 401.012352 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LVqgy64xIr3
Name 1H-pyrazole-5-carboxamide, N-(5-bromo-2-pyridinyl)-3-nitro-1-(phenylmethyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 401.012352263 u
Formula C16H12BrN5O3
InChI InChI=1S/C16H12BrN5O3/c17-12-6-7-14(18-9-12)19-16(23)13-8-15(22(24)25)20-21(13)10-11-4-2-1-3-5-11/h1-9H,10H2,(H,18,19,23)
InChIKey IDJQVSKCPSVNHM-UHFFFAOYSA-N
Molecular Weight 402.208 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_13558
Solvent DMSO-d6
Source Vendor ID: ZI/10019783; Lab Info: PNA; Lab Number: PNA-1990415