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ethyl 6-bromo-5-hydroxy-2-[(phenylsulfanyl)methyl]-1H-indole-3-carboxylate
SpectraBase Compound ID 9RbPMSLMjsT
InChI InChI=1S/C18H16BrNO3S/c1-2-23-18(22)17-12-8-16(21)13(19)9-14(12)20-15(17)10-24-11-6-4-3-5-7-11/h3-9,20-21H,2,10H2,1H3
InChIKey VLTJTKQTPCTKQE-UHFFFAOYSA-N
Mol Weight 406.29 g/mol
Molecular Formula C18H16BrNO3S
Exact Mass 405.003428 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8e1fVKkAz2h
Name ethyl 6-bromo-5-hydroxy-2-[(phenylsulfanyl)methyl]-1H-indole-3-carboxylate
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/C18H16BrNO3S/c1-2-23-18(22)17-12-8-16(21)13(19)9-14(12)20-15(17)10-24-11-6-4-3-5-7-11/h3-9,20-21H,2,10H2,1H3
InChIKey VLTJTKQTPCTKQE-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7000_3931
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: NMR/8305288; Labnumber: JMR-D000245; IOH_ID: IOH-003932
Temperature 303 °C