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3-(4-tert-butylphenyl)-4-methyl-5-[(1-naphthylmethyl)sulfanyl]-4H-1,2,4-triazole

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3-(4-tert-butylphenyl)-4-methyl-5-[(1-naphthylmethyl)sulfanyl]-4H-1,2,4-triazole
SpectraBase Compound ID KZjxPJ4x3Ga
InChI InChI=1S/C24H25N3S/c1-24(2,3)20-14-12-18(13-15-20)22-25-26-23(27(22)4)28-16-19-10-7-9-17-8-5-6-11-21(17)19/h5-15H,16H2,1-4H3
InChIKey QVQWEJZOOKMWCC-UHFFFAOYSA-N
Mol Weight 387.55 g/mol
Molecular Formula C24H25N3S
Exact Mass 387.176919 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5LJwJURLUUt
Name 3-(4-tert-butylphenyl)-4-methyl-5-[(1-naphthylmethyl)sulfanyl]-4H-1,2,4-triazole
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/C24H25N3S/c1-24(2,3)20-14-12-18(13-15-20)22-25-26-23(27(22)4)28-16-19-10-7-9-17-8-5-6-11-21(17)19/h5-15H,16H2,1-4H3
InChIKey QVQWEJZOOKMWCC-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14527
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: D98649; Labnumber: GRES-24342; SBI_ID: SBI-014530
Synonyms 5-(4-tert-butylphenyl)-4-methyl-4H-1,2,4-triazol-3-yl 1-naphthylmethyl sulfide
Temperature 308 °C