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3-[(4-bromophenoxy)methyl]-4-methoxybenzaldehyde N-phenylthiosemicarbazone
SpectraBase Compound ID BvShwBMuu58
InChI InChI=1S/C22H20BrN3O2S/c1-27-21-12-7-16(13-17(21)15-28-20-10-8-18(23)9-11-20)14-24-26-22(29)25-19-5-3-2-4-6-19/h2-14H,15H2,1H3,(H2,25,26,29)/b24-14+
InChIKey ATGMQSJVJWROII-ZVHZXABRSA-N
Mol Weight 470.39 g/mol
Molecular Formula C22H20BrN3O2S
Exact Mass 469.045961 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6rEWmKGKNnm
Name 3-[(4-bromophenoxy)methyl]-4-methoxybenzaldehyde N-phenylthiosemicarbazone
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/C22H20BrN3O2S/c1-27-21-12-7-16(13-17(21)15-28-20-10-8-18(23)9-11-20)14-24-26-22(29)25-19-5-3-2-4-6-19/h2-14H,15H2,1H3,(H2,25,26,29)/b24-14+
InChIKey ATGMQSJVJWROII-ZVHZXABRSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_16128
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: D09990; Labnumber: KHAN-0604; SBI_ID: SBI-016131
Temperature 308 °C