4-(1,3-dithioxo-1H-benzo[de]isoquinolin-2(3H)-yl)benzoic acid

SpectraBase Compound ID	BkyZdCbBy5w
InChI	InChI=1S/C19H11NO2S2/c21-19(22)12-7-9-13(10-8-12)20-17(23)14-5-1-3-11-4-2-6-15(16(11)14)18(20)24/h1-10H,(H,21,22)
InChIKey	AWATZEYWNRZITM-UHFFFAOYSA-N Google Search
Mol Weight	349.42 g/mol
Molecular Formula	C19H11NO2S2
Exact Mass	349.023121 g/mol

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SpectraBase Spectrum ID	4E5z26laQpT
Name	4-(1,3-dithioxo-1H-benzo[de]isoquinolin-2(3H)-yl)benzoic acid
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/C19H11NO2S2/c21-19(22)12-7-9-13(10-8-12)20-17(23)14-5-1-3-11-4-2-6-15(16(11)14)18(20)24/h1-10H,(H,21,22)
InChIKey	AWATZEYWNRZITM-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_17648
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: 987/00005900; Labnumber: 987/00005900218872; VK_ID: VK-017653
Temperature	318 °C