butanoic acid, 4-[(3-cyano-6-phenyl-2-pyridinyl)thio]-3-oxo-, ethyl ester

SpectraBase Compound ID	BKb6ivKjtqf
InChI	InChI=1S/C18H16N2O3S/c1-2-23-17(22)10-15(21)12-24-18-14(11-19)8-9-16(20-18)13-6-4-3-5-7-13/h3-9H,2,10,12H2,1H3
InChIKey	PSRXLGGVLAVANJ-UHFFFAOYSA-N Google Search
Mol Weight	340.4 g/mol
Molecular Formula	C18H16N2O3S
Exact Mass	340.088164 g/mol

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SpectraBase Spectrum ID	KLH08C94Pqz
Name	butanoic acid, 4-[(3-cyano-6-phenyl-2-pyridinyl)thio]-3-oxo-, ethyl ester
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/C18H16N2O3S/c1-2-23-17(22)10-15(21)12-24-18-14(11-19)8-9-16(20-18)13-6-4-3-5-7-13/h3-9H,2,10,12H2,1H3
InChIKey	PSRXLGGVLAVANJ-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_8516_1097
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: 63TSH0.242; IOH_ID: IOH-008099