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5-[(4-cyclohexylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl N-phenylbenzenecarbohydrazonothioate
SpectraBase Compound ID CGhXuDVD21A
InChI InChI=1S/C34H33N5OS/c1-5-13-26(14-6-1)27-21-23-31(24-22-27)40-25-32-36-38-34(39(32)30-19-11-4-12-20-30)41-33(28-15-7-2-8-16-28)37-35-29-17-9-3-10-18-29/h2-4,7-12,15-24,26,35H,1,5-6,13-14,25H2/b37-33+
InChIKey MEDLAMOUACABIV-LAWMERGMSA-N
Mol Weight 559.7 g/mol
Molecular Formula C34H33N5OS
Exact Mass 559.240582 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4L2FbHF3pcC
Name 5-[(4-cyclohexylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl N-phenylbenzenecarbohydrazonothioate
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/C34H33N5OS/c1-5-13-26(14-6-1)27-21-23-31(24-22-27)40-25-32-36-38-34(39(32)30-19-11-4-12-20-30)41-33(28-15-7-2-8-16-28)37-35-29-17-9-3-10-18-29/h2-4,7-12,15-24,26,35H,1,5-6,13-14,25H2/b37-33+
InChIKey MEDLAMOUACABIV-LAWMERGMSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_3624
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: 116126; Labnumber: SPGAL3-0002; VK_ID: VK-003625
Temperature 315 °C