acetic acid, [[3-cyano-4-(3-ethoxy-4-hydroxyphenyl)-1,4,5,6-tetrahydro-6-oxo-2-pyridinyl]thio]-, ethyl ester

SpectraBase Compound ID	3XsXRzoDnv4
InChI	InChI=1S/C18H20N2O5S/c1-3-24-15-7-11(5-6-14(15)21)12-8-16(22)20-18(13(12)9-19)26-10-17(23)25-4-2/h5-7,12,21H,3-4,8,10H2,1-2H3,(H,20,22)
InChIKey	ISYKQYVFFVLHBQ-UHFFFAOYSA-N Google Search
Mol Weight	376.43 g/mol
Molecular Formula	C18H20N2O5S
Exact Mass	376.109293 g/mol

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SpectraBase Spectrum ID	8YCHKa4rMSs
Name	acetic acid, [[3-cyano-4-(3-ethoxy-4-hydroxyphenyl)-1,4,5,6-tetrahydro-6-oxo-2-pyridinyl]thio]-, ethyl ester
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C18H20N2O5S/c1-3-24-15-7-11(5-6-14(15)21)12-8-16(22)20-18(13(12)9-19)26-10-17(23)25-4-2/h5-7,12,21H,3-4,8,10H2,1-2H3,(H,20,22)
InChIKey	ISYKQYVFFVLHBQ-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_3517_2094
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/11238360