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

*Links on SpectraBase are not permalinks.
acetamide, N-(4-acetylphenyl)-2-[[4-(1,3-benzodioxol-5-yl)-3-cyano-1,4,5,6,7,8-hexahydro-5-oxo-2-quinolinyl]thio]-
SpectraBase Compound ID Ccb9HbZ8y8m
InChI InChI=1S/C27H23N3O5S/c1-15(31)16-5-8-18(9-6-16)29-24(33)13-36-27-19(12-28)25(26-20(30-27)3-2-4-21(26)32)17-7-10-22-23(11-17)35-14-34-22/h5-11,25,30H,2-4,13-14H2,1H3,(H,29,33)
InChIKey YWFYBZPFLQDVPH-UHFFFAOYSA-N
Mol Weight 501.56 g/mol
Molecular Formula C27H23N3O5S
Exact Mass 501.135842 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 8fuG3UrQlnt
Name acetamide, N-(4-acetylphenyl)-2-[[4-(1,3-benzodioxol-5-yl)-3-cyano-1,4,5,6,7,8-hexahydro-5-oxo-2-quinolinyl]thio]-
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/C27H23N3O5S/c1-15(31)16-5-8-18(9-6-16)29-24(33)13-36-27-19(12-28)25(26-20(30-27)3-2-4-21(26)32)17-7-10-22-23(11-17)35-14-34-22/h5-11,25,30H,2-4,13-14H2,1H3,(H,29,33)
InChIKey YWFYBZPFLQDVPH-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_2492
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/11238859