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2-{[4-allyl-5-(4-toluidinomethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[1-(4-bromophenyl)ethylidene]propanohydrazide
SpectraBase Compound ID 6yVnXvqTPcJ
InChI InChI=1S/C24H27BrN6OS/c1-5-14-31-22(15-26-21-12-6-16(2)7-13-21)28-30-24(31)33-18(4)23(32)29-27-17(3)19-8-10-20(25)11-9-19/h5-13,18,26H,1,14-15H2,2-4H3,(H,29,32)
InChIKey INZBLDRXMNTSMB-UHFFFAOYSA-N
Mol Weight 527.49 g/mol
Molecular Formula C24H27BrN6OS
Exact Mass 526.115044 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6713AZbIfbq
Name 2-{[4-allyl-5-(4-toluidinomethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[1-(4-bromophenyl)ethylidene]propanohydrazide
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/C24H27BrN6OS/c1-5-14-31-22(15-26-21-12-6-16(2)7-13-21)28-30-24(31)33-18(4)23(32)29-27-17(3)19-8-10-20(25)11-9-19/h5-13,18,26H,1,14-15H2,2-4H3,(H,29,32)
InChIKey INZBLDRXMNTSMB-UHFFFAOYSA-N
NMR Offset 16.0772
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_16690
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/8168468; UBI_ID: UBI-016693
Temperature 308 °C