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2-(2-{4-[(4-fluorobenzoyl)amino]-1,2,5-oxadiazol-3-yl}-1H-benzimidazol-1-yl)ethyl 4-fluorobenzoate
SpectraBase Compound ID 8eRQukXpUWl
InChI InChI=1S/C25H17F2N5O4/c26-17-9-5-15(6-10-17)24(33)29-22-21(30-36-31-22)23-28-19-3-1-2-4-20(19)32(23)13-14-35-25(34)16-7-11-18(27)12-8-16/h1-12H,13-14H2,(H,29,31,33)
InChIKey YSJAKWHKXOXQQE-UHFFFAOYSA-N
Mol Weight 489.44 g/mol
Molecular Formula C25H17F2N5O4
Exact Mass 489.12486 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 94fAKRrEtDC
Name benzoic acid, 4-fluoro-, 2-[2-[4-[(4-fluorobenzoyl)amino]-1,2,5-oxadiazol-3-yl]-1H-benzimidazol-1-yl]ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 489.124860369 u
Formula C25H17F2N5O4
InChI InChI=1S/C25H17F2N5O4/c26-17-9-5-15(6-10-17)24(33)29-22-21(30-36-31-22)23-28-19-3-1-2-4-20(19)32(23)13-14-35-25(34)16-7-11-18(27)12-8-16/h1-12H,13-14H2,(H,29,31,33)
InChIKey YSJAKWHKXOXQQE-UHFFFAOYSA-N
Molecular Weight 489.439 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_11234
Solvent DMSO-d6
Source Vendor ID: NMR/10252060; Lab Info: SAD; Lab Number: 1935