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1-(3-Chloranyl-4-methyl-phenyl)-2,6,6-trimethyl-3-[2,2,2-tris(chloranyl)ethyl]-5,7-dihydroindol-4-one
SpectraBase Compound ID Fx3vBsolUhZ
InChI InChI=1S/C20H21Cl4NO/c1-11-5-6-13(7-15(11)21)25-12(2)14(8-20(22,23)24)18-16(25)9-19(3,4)10-17(18)26/h5-7H,8-10H2,1-4H3
InChIKey QNRUFLBANKREBZ-UHFFFAOYSA-N
Mol Weight 433.2 g/mol
Molecular Formula C20H21Cl4NO
Exact Mass 431.037725 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4KDhXuZPcUO
Name 4H-indol-4-one, 1-(3-chloro-4-methylphenyl)-1,5,6,7-tetrahydro-2,6,6-trimethyl-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 431.037725099 u
Formula C20H21Cl4NO
InChI InChI=1S/C20H21Cl4NO/c1-11-5-6-13(7-15(11)21)25-12(2)14(8-20(22,23)24)18-16(25)9-19(3,4)10-17(18)26/h5-7H,8-10H2,1-4H3
InChIKey QNRUFLBANKREBZ-UHFFFAOYSA-N
Molecular Weight 433.206 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_11842
Solvent DMSO-d6
Source Vendor ID: NMR/10261641; Lab Info: DUD; Lab Number: DUD-DKAD016