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ethyl 2-[(2,4-dimethylbenzyl)sulfanyl]-5-methyl-7-(4-nitrophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate

View entire compound with spectra: 1 NMR

ethyl 2-[(2,4-dimethylbenzyl)sulfanyl]-5-methyl-7-(4-nitrophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
SpectraBase Compound ID FZdzAsbGSic
InChI InChI=1S/C24H25N5O4S/c1-5-33-22(30)20-16(4)25-23-26-24(34-13-18-7-6-14(2)12-15(18)3)27-28(23)21(20)17-8-10-19(11-9-17)29(31)32/h6-12,21H,5,13H2,1-4H3,(H,25,26,27)
InChIKey SKVKMKXAMLZTCK-UHFFFAOYSA-N
Mol Weight 479.56 g/mol
Molecular Formula C24H25N5O4S
Exact Mass 479.162725 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7kYIrVI1bh3
Name ethyl 2-[(2,4-dimethylbenzyl)sulfanyl]-5-methyl-7-(4-nitrophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 479.162725475 u
Formula C24H25N5O4S
InChI InChI=1S/C24H25N5O4S/c1-5-33-22(30)20-16(4)25-23-26-24(34-13-18-7-6-14(2)12-15(18)3)27-28(23)21(20)17-8-10-19(11-9-17)29(31)32/h6-12,21H,5,13H2,1-4H3,(H,25,26,27)
InChIKey SKVKMKXAMLZTCK-UHFFFAOYSA-N
Molecular Weight 479.555 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_7587
Solvent DMSO-d6
Source Vendor ID: NMR/12329867