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4-[(6-chloro-1,3-benzothiazol-2-yl)amino]-4-oxobutanoic acid

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4-[(6-chloro-1,3-benzothiazol-2-yl)amino]-4-oxobutanoic acid
SpectraBase Compound ID KfPTFh1MNlp
InChI InChI=1S/C11H9ClN2O3S/c12-6-1-2-7-8(5-6)18-11(13-7)14-9(15)3-4-10(16)17/h1-2,5H,3-4H2,(H,16,17)(H,13,14,15)
InChIKey GLIYHNXMOHFKLT-UHFFFAOYSA-N
Mol Weight 284.72 g/mol
Molecular Formula C11H9ClN2O3S
Exact Mass 284.002241 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6VO69eHew0i
Name 4-[(6-chloro-1,3-benzothiazol-2-yl)amino]-4-oxobutanoic 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/C11H9ClN2O3S/c12-6-1-2-7-8(5-6)18-11(13-7)14-9(15)3-4-10(16)17/h1-2,5H,3-4H2,(H,16,17)(H,13,14,15)
InChIKey GLIYHNXMOHFKLT-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_4396
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/8119050; UBI_ID: UBI-004397
Temperature 318 °C