(2E)-3-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-2-propenenitrile

SpectraBase Compound ID	GXUPzXvpPZS
InChI	InChI=1S/C22H13N3O6S/c1-30-19-8-12(7-17(20(19)26)25(28)29)6-14(10-23)21-24-16(11-32-21)15-9-13-4-2-3-5-18(13)31-22(15)27/h2-9,11,26H,1H3/b14-6+
InChIKey	XBUUMBHSKURXKE-MKMNVTDBSA-N Google Search
Mol Weight	447.42 g/mol
Molecular Formula	C22H13N3O6S
Exact Mass	447.052506 g/mol

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SpectraBase Spectrum ID	HB6fJCWLi09
Name	(2E)-3-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-2-propenenitrile
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/C22H13N3O6S/c1-30-19-8-12(7-17(20(19)26)25(28)29)6-14(10-23)21-24-16(11-32-21)15-9-13-4-2-3-5-18(13)31-22(15)27/h2-9,11,26H,1H3/b14-6+
InChIKey	XBUUMBHSKURXKE-MKMNVTDBSA-N
NMR Offset	18.2243
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_1980
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: C99554; Labnumber: ULGA8-0777; SBI_ID: SBI-001982
Synonyms	3-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-2-propenenitrile
Temperature	318 °C