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4-{[(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino}benzoic acid
SpectraBase Compound ID 6fokxwtIkJ2
InChI InChI=1S/C16H12N2O4S/c19-14(17-11-7-5-10(6-8-11)15(20)21)9-23-16-18-12-3-1-2-4-13(12)22-16/h1-8H,9H2,(H,17,19)(H,20,21)
InChIKey CNSQETRMTCZBJR-UHFFFAOYSA-N
Mol Weight 328.34 g/mol
Molecular Formula C16H12N2O4S
Exact Mass 328.051778 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID B5EnCO8CmEK
Name 4-{[(1,3-benzoxazol-2-ylsulfanyl)acetyl]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/C16H12N2O4S/c19-14(17-11-7-5-10(6-8-11)15(20)21)9-23-16-18-12-3-1-2-4-13(12)22-16/h1-8H,9H2,(H,17,19)(H,20,21)
InChIKey CNSQETRMTCZBJR-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_18167
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/1010164; Labnumber: TCQ0148; UZI_ID: UZI-018174
Temperature 313 °C