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2-{[5-(4-tert-butylphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-mesitylacetamide
SpectraBase Compound ID Dvufq2OEar6
InChI InChI=1S/C24H30N4OS/c1-15-12-16(2)21(17(3)13-15)25-20(29)14-30-23-27-26-22(28(23)7)18-8-10-19(11-9-18)24(4,5)6/h8-13H,14H2,1-7H3,(H,25,29)
InChIKey WHBFWSBARSRPLX-UHFFFAOYSA-N
Mol Weight 422.59 g/mol
Molecular Formula C24H30N4OS
Exact Mass 422.214033 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID i2RMlQkxq7
Name 2-{[5-(4-tert-butylphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-mesitylacetamide
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/C24H30N4OS/c1-15-12-16(2)21(17(3)13-15)25-20(29)14-30-23-27-26-22(28(23)7)18-8-10-19(11-9-18)24(4,5)6/h8-13H,14H2,1-7H3,(H,25,29)
InChIKey WHBFWSBARSRPLX-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4360
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: D98876; Labnumber: GRES-27645; SBI_ID: SBI-004362
Temperature 306 °C