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5-bromo-8-[(carboxymethyl)sulfanyl]-1-naphthoic acid

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5-bromo-8-[(carboxymethyl)sulfanyl]-1-naphthoic acid
SpectraBase Compound ID IBzDlBD2yWa
InChI InChI=1S/C13H9BrO4S/c14-9-4-5-10(19-6-11(15)16)12-7(9)2-1-3-8(12)13(17)18/h1-5H,6H2,(H,15,16)(H,17,18)
InChIKey KAUANGMCOFRZNB-UHFFFAOYSA-N
Mol Weight 341.18 g/mol
Molecular Formula C13H9BrO4S
Exact Mass 339.940493 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ImkcK4dWAn0
Name 5-bromo-8-[(carboxymethyl)sulfanyl]-1-naphthoic 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/C13H9BrO4S/c14-9-4-5-10(19-6-11(15)16)12-7(9)2-1-3-8(12)13(17)18/h1-5H,6H2,(H,15,16)(H,17,18)
InChIKey KAUANGMCOFRZNB-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_5124
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: E13429; Labnumber: RRYB-4410; SBI_ID: SBI-005126
Temperature 315 °C