For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
acetamide, 2-[[4-(1,3-benzodioxol-5-yl)-3-cyano-1,4,5,6,7,8-hexahydro-5-oxo-2-quinolinyl]thio]-N-(phenylmethyl)-
SpectraBase Compound ID 5DWk4rWgYKW
InChI InChI=1S/C26H23N3O4S/c27-12-18-24(17-9-10-21-22(11-17)33-15-32-21)25-19(7-4-8-20(25)30)29-26(18)34-14-23(31)28-13-16-5-2-1-3-6-16/h1-3,5-6,9-11,24,29H,4,7-8,13-15H2,(H,28,31)
InChIKey IJTPJNVKJWUFQL-UHFFFAOYSA-N
Mol Weight 473.55 g/mol
Molecular Formula C26H23N3O4S
Exact Mass 473.140927 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2ZHaOKH0mCL
Name acetamide, 2-[[4-(1,3-benzodioxol-5-yl)-3-cyano-1,4,5,6,7,8-hexahydro-5-oxo-2-quinolinyl]thio]-N-(phenylmethyl)-
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/C26H23N3O4S/c27-12-18-24(17-9-10-21-22(11-17)33-15-32-21)25-19(7-4-8-20(25)30)29-26(18)34-14-23(31)28-13-16-5-2-1-3-6-16/h1-3,5-6,9-11,24,29H,4,7-8,13-15H2,(H,28,31)
InChIKey IJTPJNVKJWUFQL-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_2485
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: NMR/11238852