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2-Methyl-1-(4-nitrophenyl)-3-(2,2,2-trichloroethyl)-1,5,6,7-tetrahydro-4H-indol-4-one

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2-Methyl-1-(4-nitrophenyl)-3-(2,2,2-trichloroethyl)-1,5,6,7-tetrahydro-4H-indol-4-one
SpectraBase Compound ID CYqO1p5Eq5K
InChI InChI=1S/C17H15Cl3N2O3/c1-10-13(9-17(18,19)20)16-14(3-2-4-15(16)23)21(10)11-5-7-12(8-6-11)22(24)25/h5-8H,2-4,9H2,1H3
InChIKey FNNNEWCYVTXSAL-UHFFFAOYSA-N
Mol Weight 401.68 g/mol
Molecular Formula C17H15Cl3N2O3
Exact Mass 400.014825 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4anyIxmgoMI
Name 4H-indol-4-one, 1,5,6,7-tetrahydro-2-methyl-1-(4-nitrophenyl)-3-(2,2,2-trichloroethyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 400.014825448 u
Formula C17H15Cl3N2O3
InChI InChI=1S/C17H15Cl3N2O3/c1-10-13(9-17(18,19)20)16-14(3-2-4-15(16)23)21(10)11-5-7-12(8-6-11)22(24)25/h5-8H,2-4,9H2,1H3
InChIKey FNNNEWCYVTXSAL-UHFFFAOYSA-N
Molecular Weight 401.677 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_11830
Solvent DMSO-d6
Source Vendor ID: NMR/10261629; Lab Info: DUD; Lab Number: DUD-DKAD004