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2-{[5-(3-aminophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-benzhydrylacetamide
SpectraBase Compound ID 30EYsceMN0j
InChI InChI=1S/C24H23N5OS/c1-29-23(19-13-8-14-20(25)15-19)27-28-24(29)31-16-21(30)26-22(17-9-4-2-5-10-17)18-11-6-3-7-12-18/h2-15,22H,16,25H2,1H3,(H,26,30)
InChIKey XQYPKZOEIIQCGC-UHFFFAOYSA-N
Mol Weight 429.54 g/mol
Molecular Formula C24H23N5OS
Exact Mass 429.162332 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AKAB1imB1NG
Name 2-{[5-(3-aminophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-benzhydrylacetamide
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/C24H23N5OS/c1-29-23(19-13-8-14-20(25)15-19)27-28-24(29)31-16-21(30)26-22(17-9-4-2-5-10-17)18-11-6-3-7-12-18/h2-15,22H,16,25H2,1H3,(H,26,30)
InChIKey XQYPKZOEIIQCGC-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_7261
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: D28932; Labnumber: SPKOL-4515; SBI_ID: SBI-007264
Temperature 306 °C