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benzoic acid, 2-[[4-[(2-chloro-6-fluorophenyl)methoxy]benzoyl]amino]-,methyl ester
SpectraBase Compound ID DYU359U0447
InChI InChI=1S/C22H17ClFNO4/c1-28-22(27)16-5-2-3-8-20(16)25-21(26)14-9-11-15(12-10-14)29-13-17-18(23)6-4-7-19(17)24/h2-12H,13H2,1H3,(H,25,26)
InChIKey DTKSKWLINQGWDL-UHFFFAOYSA-N
Mol Weight 413.83 g/mol
Molecular Formula C22H17ClFNO4
Exact Mass 413.083014 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4oyCGtcVrCz
Name benzoic acid, 2-[[4-[(2-chloro-6-fluorophenyl)methoxy]benzoyl]amino]-,methyl 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 413.083013890 u
Formula C22H17ClFNO4
InChI InChI=1S/C22H17ClFNO4/c1-28-22(27)16-5-2-3-8-20(16)25-21(26)14-9-11-15(12-10-14)29-13-17-18(23)6-4-7-19(17)24/h2-12H,13H2,1H3,(H,25,26)
InChIKey DTKSKWLINQGWDL-UHFFFAOYSA-N
Molecular Weight 413.832 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16258
Solvent DMSO-d6
Source Vendor ID: ZI/10030906; Lab Info: PNA; Lab Number: PNA-1992787