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

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1-Benzyl-2,6,6-trimethyl-3-(2,2,2-trichloroethyl)-1,5,6,7-tetrahydro-4H-indol-4-one
SpectraBase Compound ID 69qWxDWUEM1
InChI InChI=1S/C20H22Cl3NO/c1-13-15(9-20(21,22)23)18-16(10-19(2,3)11-17(18)25)24(13)12-14-7-5-4-6-8-14/h4-8H,9-12H2,1-3H3
InChIKey MUKORLJEKLUXDU-UHFFFAOYSA-N
Mol Weight 398.76 g/mol
Molecular Formula C20H22Cl3NO
Exact Mass 397.076697 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 71RXCr57Hhj
Name 4H-indol-4-one, 1,5,6,7-tetrahydro-2,6,6-trimethyl-1-(phenylmethyl)-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 397.076697431 u
Formula C20H22Cl3NO
InChI InChI=1S/C20H22Cl3NO/c1-13-15(9-20(21,22)23)18-16(10-19(2,3)11-17(18)25)24(13)12-14-7-5-4-6-8-14/h4-8H,9-12H2,1-3H3
InChIKey MUKORLJEKLUXDU-UHFFFAOYSA-N
Molecular Weight 398.761 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_11848
Solvent DMSO-d6
Source Vendor ID: NMR/10261649; Lab Info: DUD; Lab Number: DUD-DKAD024