(2E)-4-[(1,1-dioxidotetrahydro-3-thienyl)(methyl)amino]-4-oxo-2-butenoic acid

SpectraBase Compound ID	6M4t8kkAoOj
InChI	InChI=1S/C9H13NO5S/c1-10(8(11)2-3-9(12)13)7-4-5-16(14,15)6-7/h2-3,7H,4-6H2,1H3,(H,12,13)/b3-2+
InChIKey	RTPGEMIHAYORPM-NSCUHMNNSA-N Google Search
Mol Weight	247.26 g/mol
Molecular Formula	C9H13NO5S
Exact Mass	247.051444 g/mol

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SpectraBase Spectrum ID	5aGY6HYRtgU
Name	(2E)-4-[(1,1-dioxidotetrahydro-3-thienyl)(methyl)amino]-4-oxo-2-butenoic acid
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/C9H13NO5S/c1-10(8(11)2-3-9(12)13)7-4-5-16(14,15)6-7/h2-3,7H,4-6H2,1H3,(H,12,13)/b3-2+
InChIKey	RTPGEMIHAYORPM-NSCUHMNNSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_16147
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: D22001; Labnumber: PAR0477; SBI_ID: SBI-016150
Synonyms	4-[(1,1-dioxidotetrahydro-3-thienyl)(methyl)amino]-4-oxo-2-butenoic acid
Temperature	318 °C