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2-{[5-(2-chlorophenyl)-4-(2-furylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,5-dichlorophenyl)acetamide
SpectraBase Compound ID CdfotQcFIaf
InChI InChI=1S/C21H15Cl3N4O2S/c22-13-8-14(23)10-15(9-13)25-19(29)12-31-21-27-26-20(17-5-1-2-6-18(17)24)28(21)11-16-4-3-7-30-16/h1-10H,11-12H2,(H,25,29)
InChIKey HOGCRRHNIDXXFB-UHFFFAOYSA-N
Mol Weight 493.8 g/mol
Molecular Formula C21H15Cl3N4O2S
Exact Mass 491.99813 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1lw9lG6x5uD
Name 2-{[5-(2-chlorophenyl)-4-(2-furylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,5-dichlorophenyl)acetamide
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/C21H15Cl3N4O2S/c22-13-8-14(23)10-15(9-13)25-19(29)12-31-21-27-26-20(17-5-1-2-6-18(17)24)28(21)11-16-4-3-7-30-16/h1-10H,11-12H2,(H,25,29)
InChIKey HOGCRRHNIDXXFB-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4354
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: D98868; Labnumber: GRES-27567; SBI_ID: SBI-004356
Temperature 306 °C