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5-(4-methoxybenzoyl)-4,4,8-trimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione
SpectraBase Compound ID JrbI801M7y9
InChI InChI=1S/C21H19NO2S3/c1-12-5-10-16-15(11-12)17-18(26-27-20(17)25)21(2,3)22(16)19(23)13-6-8-14(24-4)9-7-13/h5-11H,1-4H3
InChIKey CPBRTESNYFLWKJ-UHFFFAOYSA-N
Mol Weight 413.57 g/mol
Molecular Formula C21H19NO2S3
Exact Mass 413.057792 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8aliHW342Uy
Name 5-(4-methoxybenzoyl)-4,4,8-trimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione
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/C21H19NO2S3/c1-12-5-10-16-15(11-12)17-18(26-27-20(17)25)21(2,3)22(16)19(23)13-6-8-14(24-4)9-7-13/h5-11H,1-4H3
InChIKey CPBRTESNYFLWKJ-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_20781
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: S14568; Labnumber: RV6-1060; SBI_ID: SBI-020785
Temperature 315 °C