5-[[2-(4-Iodophenoxy)-1-oxoethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester

SpectraBase Compound ID	24kOAEsCqtL
InChI	InChI=1S/C19H20INO6S/c1-4-25-18(23)15-11(3)16(19(24)26-5-2)28-17(15)21-14(22)10-27-13-8-6-12(20)7-9-13/h6-9H,4-5,10H2,1-3H3,(H,21,22)
InChIKey	YFLLWUBYGADNPH-UHFFFAOYSA-N Google Search
Mol Weight	517.33 g/mol
Molecular Formula	C19H20INO6S
Exact Mass	517.005604 g/mol

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SpectraBase Spectrum ID	KBIVgbPkNyQ
Name	2,4-thiophenedicarboxylic acid, 5-[[(4-iodophenoxy)acetyl]amino]-3-methyl-, diethyl ester
Copyright	Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	517.005603536 u
Formula	C19H20INO6S
InChI	InChI=1S/C19H20INO6S/c1-4-25-18(23)15-11(3)16(19(24)26-5-2)28-17(15)21-14(22)10-27-13-8-6-12(20)7-9-13/h6-9H,4-5,10H2,1-3H3,(H,21,22)
InChIKey	YFLLWUBYGADNPH-UHFFFAOYSA-N
Molecular Weight	517.334 g/mol
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2017_13984
Solvent	DMSO-d6
Source	Vendor ID: ZI/10022924; Lab Info: PNA; Lab Number: PNA-1991572