4-nitro-2-[(Z)-(3-oxo-1-benzothien-2(3H)-ylidene)methyl]phenyl acetate

SpectraBase Compound ID	5qpD9gnogSI
InChI	InChI=1S/C17H11NO5S/c1-10(19)23-14-7-6-12(18(21)22)8-11(14)9-16-17(20)13-4-2-3-5-15(13)24-16/h2-9H,1H3/b16-9-
InChIKey	JIURJIDKDBJSPL-SXGWCWSVSA-N Google Search
Mol Weight	341.34 g/mol
Molecular Formula	C17H11NO5S
Exact Mass	341.035794 g/mol

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SpectraBase Spectrum ID	K2BhCBigRhu
Name	4-nitro-2-[(Z)-(3-oxo-1-benzothien-2(3H)-ylidene)methyl]phenyl acetate
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/C17H11NO5S/c1-10(19)23-14-7-6-12(18(21)22)8-11(14)9-16-17(20)13-4-2-3-5-15(13)24-16/h2-9H,1H3/b16-9-
InChIKey	JIURJIDKDBJSPL-SXGWCWSVSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_8937
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: 133871; Labnumber: RRKR-1080; VK_ID: VK-008941
Synonyms	4-nitro-2-[(3-oxo-1-benzothien-2(3H)-ylidene)methyl]phenyl acetate
Temperature	318 °C