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1-[(3-chloro-6-nitro-1-benzothien-2-yl)carbonyl]-2,2,4,6-tetramethyl-1,2,3,4-tetrahydroquinoline
SpectraBase Compound ID AldbPksETt6
InChI InChI=1S/C22H21ClN2O3S/c1-12-5-8-17-16(9-12)13(2)11-22(3,4)24(17)21(26)20-19(23)15-7-6-14(25(27)28)10-18(15)29-20/h5-10,13H,11H2,1-4H3
InChIKey SBMUKIMQSLXZLF-UHFFFAOYSA-N
Mol Weight 428.93 g/mol
Molecular Formula C22H21ClN2O3S
Exact Mass 428.096141 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4wae6oWMkAO
Name 1-[(3-chloro-6-nitro-1-benzothien-2-yl)carbonyl]-2,2,4,6-tetramethyl-1,2,3,4-tetrahydroquinoline
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/C22H21ClN2O3S/c1-12-5-8-17-16(9-12)13(2)11-22(3,4)24(17)21(26)20-19(23)15-7-6-14(25(27)28)10-18(15)29-20/h5-10,13H,11H2,1-4H3
InChIKey SBMUKIMQSLXZLF-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_13236
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: 102432; Labnumber: VOR7-0365; VK_ID: VK-013241
Temperature 318 °C