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1H-isoindol-1-one, 2-[(2-chlorophenyl)methyl]-2,3-dihydro-3-[(2,3,4,5,6-pentafluorophenyl)amino]-
SpectraBase Compound ID EM4mHzDgugf
InChI InChI=1S/C21H12ClF5N2O/c22-13-8-4-1-5-10(13)9-29-20(11-6-2-3-7-12(11)21(29)30)28-19-17(26)15(24)14(23)16(25)18(19)27/h1-8,20,28H,9H2
InChIKey ZKROBURRASCYCG-UHFFFAOYSA-N
Mol Weight 438.79 g/mol
Molecular Formula C21H12ClF5N2O
Exact Mass 438.055832 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HZLWzhfRER3
Name 1H-isoindol-1-one, 2-[(2-chlorophenyl)methyl]-2,3-dihydro-3-[(2,3,4,5,6-pentafluorophenyl)amino]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 438.055831528 u
Formula C21H12ClF5N2O
InChI InChI=1S/C21H12ClF5N2O/c22-13-8-4-1-5-10(13)9-29-20(11-6-2-3-7-12(11)21(29)30)28-19-17(26)15(24)14(23)16(25)18(19)27/h1-8,20,28H,9H2
InChIKey ZKROBURRASCYCG-UHFFFAOYSA-N
Molecular Weight 438.785 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2996
Solvent DMSO-d6
Source Vendor ID: NMR/12689720