2,4-thiophenedicarboxylic acid, 5-[(2-chloro-5-nitrobenzoyl)amino]-3-methyl-, diethyl ester

SpectraBase Compound ID	43Qy9b6mCwn
InChI	InChI=1S/C18H17ClN2O7S/c1-4-27-17(23)13-9(3)14(18(24)28-5-2)29-16(13)20-15(22)11-8-10(21(25)26)6-7-12(11)19/h6-8H,4-5H2,1-3H3,(H,20,22)
InChIKey	JDQROWJXNBLSFG-UHFFFAOYSA-N Google Search
Mol Weight	440.85 g/mol
Molecular Formula	C18H17ClN2O7S
Exact Mass	440.0445 g/mol

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SpectraBase Spectrum ID	L6CfusPcHRK
Name	2,4-thiophenedicarboxylic acid, 5-[(2-chloro-5-nitrobenzoyl)amino]-3-methyl-, diethyl 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/C18H17ClN2O7S/c1-4-27-17(23)13-9(3)14(18(24)28-5-2)29-16(13)20-15(22)11-8-10(21(25)26)6-7-12(11)19/h6-8H,4-5H2,1-3H3,(H,20,22)
InChIKey	JDQROWJXNBLSFG-UHFFFAOYSA-N
NMR Offset	15.0036
NMR Spectrometer Frequency	250.134
Observed nucleus	1H
Origin	1H_CB_8313_1060
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/8295060; Labnumber: DS-898
Temperature	297 °C