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N'-[(E)-(3-allyl-2-hydroxyphenyl)methylidene]-2-({4-allyl-5-[(4-iodoanilino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide
SpectraBase Compound ID F5de2hpgQlC
InChI InChI=1S/C24H25IN6O2S/c1-3-6-17-7-5-8-18(23(17)33)14-27-29-22(32)16-34-24-30-28-21(31(24)13-4-2)15-26-20-11-9-19(25)10-12-20/h3-5,7-12,14,26,33H,1-2,6,13,15-16H2,(H,29,32)/b27-14+
InChIKey OMYXBXXUNWGJHZ-MZJWZYIUSA-N
Mol Weight 588.47 g/mol
Molecular Formula C24H25IN6O2S
Exact Mass 588.08044 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4InzpfDruWn
Name N'-[(E)-(3-allyl-2-hydroxyphenyl)methylidene]-2-({4-allyl-5-[(4-iodoanilino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide
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/C24H25IN6O2S/c1-3-6-17-7-5-8-18(23(17)33)14-27-29-22(32)16-34-24-30-28-21(31(24)13-4-2)15-26-20-11-9-19(25)10-12-20/h3-5,7-12,14,26,33H,1-2,6,13,15-16H2,(H,29,32)/b27-14+
InChIKey OMYXBXXUNWGJHZ-MZJWZYIUSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_16403
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/8116774; UBI_ID: UBI-016406
Synonyms N'-[(3-allyl-2-hydroxyphenyl)methylidene]-2-({4-allyl-5-[(4-iodoanilino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide
Temperature 308 °C