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2-amino-4-{4-[(4-chlorophenoxy)methyl]-5-methyl-2-thienyl}-5,6,7,8-tetrahydro-3-quinolinecarbonitrile
SpectraBase Compound ID DVkWZ3fdznb
InChI InChI=1S/C22H20ClN3OS/c1-13-14(12-27-16-8-6-15(23)7-9-16)10-20(28-13)21-17-4-2-3-5-19(17)26-22(25)18(21)11-24/h6-10H,2-5,12H2,1H3,(H2,25,26)
InChIKey BGOIWCIACQPEOX-UHFFFAOYSA-N
Mol Weight 409.94 g/mol
Molecular Formula C22H20ClN3OS
Exact Mass 409.101561 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3ZPHZhXL3Ps
Name 2-amino-4-{4-[(4-chlorophenoxy)methyl]-5-methyl-2-thienyl}-5,6,7,8-tetrahydro-3-quinolinecarbonitrile
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/C22H20ClN3OS/c1-13-14(12-27-16-8-6-15(23)7-9-16)10-20(28-13)21-17-4-2-3-5-19(17)26-22(25)18(21)11-24/h6-10H,2-5,12H2,1H3,(H2,25,26)
InChIKey BGOIWCIACQPEOX-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_14172
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent CDCl3
Source File Reference VendorID: UZI/1011065; UBI_ID: UBI-014175
Temperature 308 °C