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2-({5-[(1-naphthylamino)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-1-phenylethanone
SpectraBase Compound ID Beik8I6WiJu
InChI InChI=1S/C27H22N4OS/c32-25(21-11-3-1-4-12-21)19-33-27-30-29-26(31(27)22-14-5-2-6-15-22)18-28-24-17-9-13-20-10-7-8-16-23(20)24/h1-17,28H,18-19H2
InChIKey LJWQTIMETBSULF-UHFFFAOYSA-N
Mol Weight 450.56 g/mol
Molecular Formula C27H22N4OS
Exact Mass 450.151433 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CWBeLeZu13x
Name 2-({5-[(1-naphthylamino)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-1-phenylethanone
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/C27H22N4OS/c32-25(21-11-3-1-4-12-21)19-33-27-30-29-26(31(27)22-14-5-2-6-15-22)18-28-24-17-9-13-20-10-7-8-16-23(20)24/h1-17,28H,18-19H2
InChIKey LJWQTIMETBSULF-UHFFFAOYSA-N
NMR Offset 14.4773
NMR Spectrometer Frequency 500.138
Observed nucleus 1H
Origin 1H_UBI_21270_15964
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/8056949; UBI_ID: UBI-015967
Temperature 313 °C