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propanamide, N-[2-(5-chloro-1H-indol-3-yl)ethyl]-3-[(2-chloro-9H-purin-6-yl)thio]-
SpectraBase Compound ID 2IMfigMKcFG
InChI InChI=1S/C18H16Cl2N6OS/c19-11-1-2-13-12(7-11)10(8-22-13)3-5-21-14(27)4-6-28-17-15-16(24-9-23-15)25-18(20)26-17/h1-2,7-9,22H,3-6H2,(H,21,27)(H,23,24,25,26)
InChIKey PNANIMAHMQCRJT-UHFFFAOYSA-N
Mol Weight 435.33 g/mol
Molecular Formula C18H16Cl2N6OS
Exact Mass 434.048336 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Kwfkdx8kDth
Name propanamide, N-[2-(5-chloro-1H-indol-3-yl)ethyl]-3-[(2-chloro-9H-purin-6-yl)thio]-
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/C18H16Cl2N6OS/c19-11-1-2-13-12(7-11)10(8-22-13)3-5-21-14(27)4-6-28-17-15-16(24-9-23-15)25-18(20)26-17/h1-2,7-9,22H,3-6H2,(H,21,27)(H,23,24,25,26)
InChIKey PNANIMAHMQCRJT-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_5373
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: F25066; Labnumber: ExLab-203421