acetic acid, [[3-cyano-4,6-di(2-thienyl)-2-pyridinyl]thio]-, phenylmethyl ester

SpectraBase Compound ID	Fbg8LpiOiqx
InChI	InChI=1S/C23H16N2O2S3/c24-13-18-17(20-8-4-10-28-20)12-19(21-9-5-11-29-21)25-23(18)30-15-22(26)27-14-16-6-2-1-3-7-16/h1-12H,14-15H2
InChIKey	KWCNYNOJFMCELE-UHFFFAOYSA-N Google Search
Mol Weight	448.57 g/mol
Molecular Formula	C23H16N2O2S3
Exact Mass	448.037391 g/mol

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SpectraBase Spectrum ID	F5NWO92Tdf5
Name	acetic acid, [[3-cyano-4,6-di(2-thienyl)-2-pyridinyl]thio]-, phenylmethyl 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/C23H16N2O2S3/c24-13-18-17(20-8-4-10-28-20)12-19(21-9-5-11-29-21)25-23(18)30-15-22(26)27-14-16-6-2-1-3-7-16/h1-12H,14-15H2
InChIKey	KWCNYNOJFMCELE-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_8516_1084
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: 63TSH0.207; IOH_ID: IOH-008086