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2-(4-Bromophenyl)-1-(2-hydroxyethyl)-6,6-dimethyl-5,7-dihydroindol-4-one

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

2-(4-Bromophenyl)-1-(2-hydroxyethyl)-6,6-dimethyl-5,7-dihydroindol-4-one
SpectraBase Compound ID 87gnPTr6nbp
InChI InChI=1S/C18H20BrNO2/c1-18(2)10-16-14(17(22)11-18)9-15(20(16)7-8-21)12-3-5-13(19)6-4-12/h3-6,9,21H,7-8,10-11H2,1-2H3
InChIKey TYCJRBFEKXLIMC-UHFFFAOYSA-N
Mol Weight 362.27 g/mol
Molecular Formula C18H20BrNO2
Exact Mass 361.067742 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5bOyCLVFExv
Name 2-(4-Bromophenyl)-1-(2-hydroxyethyl)-6,6-dimethyl-5,7-dihydroindol-4-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 361.067741886 u
Formula C18H20BrNO2
InChI InChI=1S/C18H20BrNO2/c1-18(2)10-16-14(17(22)11-18)9-15(20(16)7-8-21)12-3-5-13(19)6-4-12/h3-6,9,21H,7-8,10-11H2,1-2H3
InChIKey TYCJRBFEKXLIMC-UHFFFAOYSA-N
Molecular Weight 362.267 g/mol
SMILES C=1(N(C=2CC(CC(C2C1)=O)(C)C)CCO)C=1C=CC(=CC1)Br