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N-(1-Cyclohexylethyl)-N-methyl-2-oxo-2-[1-(toluene-4-sulfonyl)-1H-indol-3-yl]acetamide
SpectraBase Compound ID L3HQHacn8RU
InChI InChI=1S/C26H30N2O4S/c1-18-13-15-21(16-14-18)33(31,32)28-17-23(22-11-7-8-12-24(22)28)25(29)26(30)27(3)19(2)20-9-5-4-6-10-20/h7-8,11-17,19-20H,4-6,9-10H2,1-3H3
InChIKey NAEHNGWPTKJNRV-UHFFFAOYSA-N
Mol Weight 466.6 g/mol
Molecular Formula C26H30N2O4S
Exact Mass 466.192629 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9ejMXaQoN9d
Name N-(1-Cyclohexylethyl)-N-methyl-2-oxo-2-[1-(toluene-4-sulfonyl)-1H-indol-3-yl]acetamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 466.192628624 u
Formula C26H30N2O4S
InChI InChI=1S/C26H30N2O4S/c1-18-13-15-21(16-14-18)33(31,32)28-17-23(22-11-7-8-12-24(22)28)25(29)26(30)27(3)19(2)20-9-5-4-6-10-20/h7-8,11-17,19-20H,4-6,9-10H2,1-3H3
InChIKey NAEHNGWPTKJNRV-UHFFFAOYSA-N
Molecular Weight 466.596 g/mol
SMILES C(C(C1=CN(C2=C1C=CC=C2)S(=O)(=O)C=1C=CC(=CC1)C)=O)(=O)N(C)C(C)C1CCCCC1