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3-(6-nitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)-N-(1,3-thiazol-2-yl)propanamide
SpectraBase Compound ID Gmv5t8VIXXM
InChI InChI=1S/C18H12N4O5S/c23-14(20-18-19-7-9-28-18)6-8-21-16(24)11-3-1-2-10-13(22(26)27)5-4-12(15(10)11)17(21)25/h1-5,7,9H,6,8H2,(H,19,20,23)
InChIKey YGURKWLVYCTAII-UHFFFAOYSA-N
Mol Weight 396.38 g/mol
Molecular Formula C18H12N4O5S
Exact Mass 396.052841 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CcWtXRn0f3j
Name 3-(6-nitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)-N-(1,3-thiazol-2-yl)propanamide
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/C18H12N4O5S/c23-14(20-18-19-7-9-28-18)6-8-21-16(24)11-3-1-2-10-13(22(26)27)5-4-12(15(10)11)17(21)25/h1-5,7,9H,6,8H2,(H,19,20,23)
InChIKey YGURKWLVYCTAII-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_2778
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: D04557; Labnumber: SPNOS-3379; SBI_ID: SBI-002780
Temperature 318 °C