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benzenesulfonic acid, 5-iodo-2-methoxy-, 8-quinolinyl ester
SpectraBase Compound ID C8SGzoN9FD1
InChI InChI=1S/C16H12INO4S/c1-21-13-8-7-12(17)10-15(13)23(19,20)22-14-6-2-4-11-5-3-9-18-16(11)14/h2-10H,1H3
InChIKey XRIURSODFNKUDE-UHFFFAOYSA-N
Mol Weight 441.24 g/mol
Molecular Formula C16H12INO4S
Exact Mass 440.953174 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Gkc0LKDeZ74
Name benzenesulfonic acid, 5-iodo-2-methoxy-, 8-quinolinyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 440.953174040 u
Formula C16H12INO4S
InChI InChI=1S/C16H12INO4S/c1-21-13-8-7-12(17)10-15(13)23(19,20)22-14-6-2-4-11-5-3-9-18-16(11)14/h2-10H,1H3
InChIKey XRIURSODFNKUDE-UHFFFAOYSA-N
Molecular Weight 441.239 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_2645
Solvent DMSO-d6
Source Vendor ID: ZI/9022028; Lab Info: DK; Lab Number: DK-1200254