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[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid, 2-(butylthio)-4,7-dihydro-5-methyl-7-(4-methylphenyl)-, ethyl ester
SpectraBase Compound ID E0yhzm35g21
InChI InChI=1S/C20H26N4O2S/c1-5-7-12-27-20-22-19-21-14(4)16(18(25)26-6-2)17(24(19)23-20)15-10-8-13(3)9-11-15/h8-11,17H,5-7,12H2,1-4H3,(H,21,22,23)
InChIKey MLQITTATXAARBG-UHFFFAOYSA-N
Mol Weight 386.51 g/mol
Molecular Formula C20H26N4O2S
Exact Mass 386.177647 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 34R9w55l7tx
Name [1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid, 2-(butylthio)-4,7-dihydro-5-methyl-7-(4-methylphenyl)-, ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 386.177647265 u
Formula C20H26N4O2S
InChI InChI=1S/C20H26N4O2S/c1-5-7-12-27-20-22-19-21-14(4)16(18(25)26-6-2)17(24(19)23-20)15-10-8-13(3)9-11-15/h8-11,17H,5-7,12H2,1-4H3,(H,21,22,23)
InChIKey MLQITTATXAARBG-UHFFFAOYSA-N
Molecular Weight 386.514 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_842
Solvent DMSO-d6
Source Vendor ID: NMR/13239306