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2H-tetrazole-2-acetic acid, 5-(1,3-benzodioxol-5-yl)-, 2-[(E)-[3-(4-fluorophenyl)-1H-pyrazol-4-yl]methylidene]hydrazide
SpectraBase Compound ID 1zuUJpBdqSa
InChI InChI=1S/C20H15FN8O3/c21-15-4-1-12(2-5-15)19-14(9-23-25-19)8-22-24-18(30)10-29-27-20(26-28-29)13-3-6-16-17(7-13)32-11-31-16/h1-9H,10-11H2,(H,23,25)(H,24,30)/b22-8+
InChIKey TTXAKUORULZGBB-GZIVZEMBSA-N
Mol Weight 434.39 g/mol
Molecular Formula C20H15FN8O3
Exact Mass 434.125115 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JyXUaft3XPw
Name 2H-tetrazole-2-acetic acid, 5-(1,3-benzodioxol-5-yl)-, 2-[(E)-[3-(4-fluorophenyl)-1H-pyrazol-4-yl]methylidene]hydrazide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 434.125114535 u
Formula C20H15FN8O3
InChI InChI=1S/C20H15FN8O3/c21-15-4-1-12(2-5-15)19-14(9-23-25-19)8-22-24-18(30)10-29-27-20(26-28-29)13-3-6-16-17(7-13)32-11-31-16/h1-9H,10-11H2,(H,23,25)(H,24,30)/b22-8+
InChIKey TTXAKUORULZGBB-GZIVZEMBSA-N
Molecular Weight 434.391 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14825
Solvent DMSO-d6
Source Vendor ID: NMR/10320257; Lab Info: SAD; Lab Number: 62