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2-{[5-(4-tert-butylphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(2-naphthyl)ethanone

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2-{[5-(4-tert-butylphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(2-naphthyl)ethanone
SpectraBase Compound ID 4wYQNw6VYna
InChI InChI=1S/C26H27N3OS/c1-5-29-24(19-12-14-22(15-13-19)26(2,3)4)27-28-25(29)31-17-23(30)21-11-10-18-8-6-7-9-20(18)16-21/h6-16H,5,17H2,1-4H3
InChIKey YJMAIQPMRDYEGM-UHFFFAOYSA-N
Mol Weight 429.58 g/mol
Molecular Formula C26H27N3OS
Exact Mass 429.187484 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ldfoBWbzky
Name 2-{[5-(4-tert-butylphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(2-naphthyl)ethanone
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/C26H27N3OS/c1-5-29-24(19-12-14-22(15-13-19)26(2,3)4)27-28-25(29)31-17-23(30)21-11-10-18-8-6-7-9-20(18)16-21/h6-16H,5,17H2,1-4H3
InChIKey YJMAIQPMRDYEGM-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4404
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: D98955; Labnumber: GRES-28983; SBI_ID: SBI-004406
Temperature 308 °C