1,3-benzenedicarboxylic acid, 5-[[[(6-ethoxy-2-benzothiazolyl)thio]acetyl]amino]-

SpectraBase Compound ID	IbDX1zfQMXs
InChI	InChI=1S/C19H16N2O6S2/c1-2-27-13-3-4-14-15(8-13)29-19(21-14)28-9-16(22)20-12-6-10(17(23)24)5-11(7-12)18(25)26/h3-8H,2,9H2,1H3,(H,20,22)(H,23,24)(H,25,26)
InChIKey	IAYWMZRXAFUTJN-UHFFFAOYSA-N Google Search
Mol Weight	432.47 g/mol
Molecular Formula	C19H16N2O6S2
Exact Mass	432.044979 g/mol

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SpectraBase Spectrum ID	Bts7wC1Yvsv
Name	1,3-benzenedicarboxylic acid, 5-[[[(6-ethoxy-2-benzothiazolyl)thio]acetyl]amino]-
Copyright	Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	432.044978585 u
Formula	C19H16N2O6S2
InChI	InChI=1S/C19H16N2O6S2/c1-2-27-13-3-4-14-15(8-13)29-19(21-14)28-9-16(22)20-12-6-10(17(23)24)5-11(7-12)18(25)26/h3-8H,2,9H2,1H3,(H,20,22)(H,23,24)(H,25,26)
InChIKey	IAYWMZRXAFUTJN-UHFFFAOYSA-N
Molecular Weight	432.465 g/mol
NMR Offset	16.0087
NMR Spectrometer Frequency	500.133
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2017_8122
Solvent	DMSO-d6
Source	Vendor ID: NMR/9311423; Lab Info: KTS; Lab Number: KTS-0000723