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2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]-N-cyclooctyl-acetamide

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2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]-N-cyclooctyl-acetamide
SpectraBase Compound ID 13wiMBlRR4V
InChI InChI=1S/C27H31ClN2O3/c1-18-23(17-26(31)29-21-8-6-4-3-5-7-9-21)24-16-22(33-2)14-15-25(24)30(18)27(32)19-10-12-20(28)13-11-19/h10-16,21H,3-9,17H2,1-2H3,(H,29,31)
InChIKey SYSUTSLCKTZTMB-UHFFFAOYSA-N
Mol Weight 467.01 g/mol
Molecular Formula C27H31ClN2O3
Exact Mass 466.202321 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FkfFKZxbuCo
Name 2-[1-(4-Chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]-N-cyclooctyl-acetamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 466.202320563 u
Formula C27H31ClN2O3
InChI InChI=1S/C27H31ClN2O3/c1-18-23(17-26(31)29-21-8-6-4-3-5-7-9-21)24-16-22(33-2)14-15-25(24)30(18)27(32)19-10-12-20(28)13-11-19/h10-16,21H,3-9,17H2,1-2H3,(H,29,31)
InChIKey SYSUTSLCKTZTMB-UHFFFAOYSA-N
Molecular Weight 467.009 g/mol
SMILES C1CCCC(NC(CC2=C(N(C3=C2C=C(C=C3)OC)C(C=2C=CC(=CC2)Cl)=O)C)=O)CCC1