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2-[(4-allyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-chloro-2-methylphenyl)acetamide

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2-[(4-allyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-chloro-2-methylphenyl)acetamide
SpectraBase Compound ID 4232R6vgS8z
InChI InChI=1S/C20H19ClN4OS/c1-3-12-25-19(15-8-5-4-6-9-15)23-24-20(25)27-13-18(26)22-17-11-7-10-16(21)14(17)2/h3-11H,1,12-13H2,2H3,(H,22,26)
InChIKey CEXGERZBDYSTEO-UHFFFAOYSA-N
Mol Weight 398.91 g/mol
Molecular Formula C20H19ClN4OS
Exact Mass 398.09681 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EdqYnZRpju9
Name 2-[(4-allyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-chloro-2-methylphenyl)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/C20H19ClN4OS/c1-3-12-25-19(15-8-5-4-6-9-15)23-24-20(25)27-13-18(26)22-17-11-7-10-16(21)14(17)2/h3-11H,1,12-13H2,2H3,(H,22,26)
InChIKey CEXGERZBDYSTEO-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4905
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: E08348; Labnumber: GRES-36953; SBI_ID: SBI-004907
Temperature 318 °C