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2-(4-Ethyl-1-piperazinyl)-5-nitro-N-[4-(trifluoromethoxy)phenyl]benzamide
SpectraBase Compound ID BO9zythvHo4
InChI InChI=1S/C20H21F3N4O4/c1-2-25-9-11-26(12-10-25)18-8-5-15(27(29)30)13-17(18)19(28)24-14-3-6-16(7-4-14)31-20(21,22)23/h3-8,13H,2,9-12H2,1H3,(H,24,28)
InChIKey QWHKCHXOPPEACM-UHFFFAOYSA-N
Mol Weight 438.41 g/mol
Molecular Formula C20H21F3N4O4
Exact Mass 438.15149 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1BPaqXVGubP
Name benzamide, 2-(4-ethyl-1-piperazinyl)-5-nitro-N-[4-(trifluoromethoxy)phenyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 438.151489657 u
Formula C20H21F3N4O4
InChI InChI=1S/C20H21F3N4O4/c1-2-25-9-11-26(12-10-25)18-8-5-15(27(29)30)13-17(18)19(28)24-14-3-6-16(7-4-14)31-20(21,22)23/h3-8,13H,2,9-12H2,1H3,(H,24,28)
InChIKey QWHKCHXOPPEACM-UHFFFAOYSA-N
Molecular Weight 438.407 g/mol
NMR Offset 16.0087
NMR Spectrometer Frequency 500.133
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_4578
Solvent DMSO-d6
Source Vendor ID: ZI/9069462; Lab Info: DS; Lab Number: DS-Z000005