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2-{[(3-chloro-6-nitro-1-benzothien-2-yl)carbonyl]amino}benzoic acid
SpectraBase Compound ID 5HVwdoW3iiE
InChI InChI=1S/C16H9ClN2O5S/c17-13-10-6-5-8(19(23)24)7-12(10)25-14(13)15(20)18-11-4-2-1-3-9(11)16(21)22/h1-7H,(H,18,20)(H,21,22)
InChIKey WBVRXGQLLWNFHD-UHFFFAOYSA-N
Mol Weight 376.77 g/mol
Molecular Formula C16H9ClN2O5S
Exact Mass 375.99207 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID U3aTdZPbi3
Name 2-{[(3-chloro-6-nitro-1-benzothien-2-yl)carbonyl]amino}benzoic 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/C16H9ClN2O5S/c17-13-10-6-5-8(19(23)24)7-12(10)25-14(13)15(20)18-11-4-2-1-3-9(11)16(21)22/h1-7H,(H,18,20)(H,21,22)
InChIKey WBVRXGQLLWNFHD-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_1845
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: 701521VOR7-0490; Labnumber: 701521VOR7-0490; VK_ID: VK-001846
Temperature 318 °C