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methyl 4-chloro-3-{[(4-cyclohexyl-1-piperazinyl)acetyl]amino}-1H-indole-2-carboxylate
SpectraBase Compound ID IXMfhqk4KjF
InChI InChI=1S/C22H29ClN4O3/c1-30-22(29)21-20(19-16(23)8-5-9-17(19)24-21)25-18(28)14-26-10-12-27(13-11-26)15-6-3-2-4-7-15/h5,8-9,15,24H,2-4,6-7,10-14H2,1H3,(H,25,28)
InChIKey NDTAIRXDIXEDBK-UHFFFAOYSA-N
Mol Weight 432.95 g/mol
Molecular Formula C22H29ClN4O3
Exact Mass 432.192819 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID I1H0uqilnaa
Name methyl 4-chloro-3-{[(4-cyclohexyl-1-piperazinyl)acetyl]amino}-1H-indole-2-carboxylate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C22H29ClN4O3/c1-30-22(29)21-20(19-16(23)8-5-9-17(19)24-21)25-18(28)14-26-10-12-27(13-11-26)15-6-3-2-4-7-15/h5,8-9,15,24H,2-4,6-7,10-14H2,1H3,(H,25,28)
InChIKey NDTAIRXDIXEDBK-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_24927
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D48940; Labnumber: SIMAK-01633; SBI_ID: SBI-024931
Temperature 308 °C