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1-[(2-chlorobenzyl)sulfanyl]-2-ethyl-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
SpectraBase Compound ID dZqEjasHAU
InChI InChI=1S/C22H18ClN3S/c1-3-16-14(2)17(12-24)21-25-19-10-6-7-11-20(19)26(21)22(16)27-13-15-8-4-5-9-18(15)23/h4-11H,3,13H2,1-2H3
InChIKey HXOIMLGSYXDAQC-UHFFFAOYSA-N
Mol Weight 391.92 g/mol
Molecular Formula C22H18ClN3S
Exact Mass 391.090996 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9QKsZUSVs7s
Name 1-[(2-chlorobenzyl)sulfanyl]-2-ethyl-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
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/C22H18ClN3S/c1-3-16-14(2)17(12-24)21-25-19-10-6-7-11-20(19)26(21)22(16)27-13-15-8-4-5-9-18(15)23/h4-11H,3,13H2,1-2H3
InChIKey HXOIMLGSYXDAQC-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_13969
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: D91429; Labnumber: POPOV-4122; SBI_ID: SBI-013972
Temperature 303 °C