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2-Methyl-1-pyridin-3-yl-3-(2,2,2-trichloro-ethyl)-1,5,6,7-tetrahydro-indol-4-one

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

2-Methyl-1-pyridin-3-yl-3-(2,2,2-trichloro-ethyl)-1,5,6,7-tetrahydro-indol-4-one
SpectraBase Compound ID KEhVRvqF5Ho
InChI InChI=1S/C16H15Cl3N2O/c1-10-12(8-16(17,18)19)15-13(5-2-6-14(15)22)21(10)11-4-3-7-20-9-11/h3-4,7,9H,2,5-6,8H2,1H3
InChIKey CKUGMHGNCKDTKE-UHFFFAOYSA-N
Mol Weight 357.67 g/mol
Molecular Formula C16H15Cl3N2O
Exact Mass 356.024996 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9ldxu3J4jMj
Name 4H-indol-4-one, 1,5,6,7-tetrahydro-2-methyl-1-(3-pyridinyl)-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 356.024996210 u
Formula C16H15Cl3N2O
InChI InChI=1S/C16H15Cl3N2O/c1-10-12(8-16(17,18)19)15-13(5-2-6-14(15)22)21(10)11-4-3-7-20-9-11/h3-4,7,9H,2,5-6,8H2,1H3
InChIKey CKUGMHGNCKDTKE-UHFFFAOYSA-N
Molecular Weight 357.668 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_11852
Solvent DMSO-d6
Source Vendor ID: NMR/10261653; Lab Info: DUD; Lab Number: DUD-DKAD028