(2E)-4-[(6-methyl-1,3-benzothiazol-2-yl)amino]-4-oxo-2-butenoic acid

SpectraBase Compound ID	8fGJmi80iDJ
InChI	InChI=1S/C12H10N2O3S/c1-7-2-3-8-9(6-7)18-12(13-8)14-10(15)4-5-11(16)17/h2-6H,1H3,(H,16,17)(H,13,14,15)/b5-4+
InChIKey	VBDYFVKCFZAMLR-SNAWJCMRSA-N Google Search
Mol Weight	262.28 g/mol
Molecular Formula	C12H10N2O3S
Exact Mass	262.041213 g/mol

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SpectraBase Spectrum ID	upYDWuVKg2
Name	(2E)-4-[(6-methyl-1,3-benzothiazol-2-yl)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/C12H10N2O3S/c1-7-2-3-8-9(6-7)18-12(13-8)14-10(15)4-5-11(16)17/h2-6H,1H3,(H,16,17)(H,13,14,15)/b5-4+
InChIKey	VBDYFVKCFZAMLR-SNAWJCMRSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_2196
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: UZI/8042221; UBI_ID: UBI-002197
Synonyms	4-[(6-methyl-1,3-benzothiazol-2-yl)amino]-4-oxo-2-butenoic acid
Temperature	318 °C