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ethyl 4-{[5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-3-oxobutanoate
SpectraBase Compound ID LVa5JN1urgq
InChI InChI=1S/C15H21N5O3S/c1-5-20-14(12-7-10(3)19(4)18-12)16-17-15(20)24-9-11(21)8-13(22)23-6-2/h7H,5-6,8-9H2,1-4H3
InChIKey CTHQUPHZYJZAJF-UHFFFAOYSA-N
Mol Weight 351.43 g/mol
Molecular Formula C15H21N5O3S
Exact Mass 351.136511 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8v80l5krYb0
Name ethyl 4-{[5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-3-oxobutanoate
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/C15H21N5O3S/c1-5-20-14(12-7-10(3)19(4)18-12)16-17-15(20)24-9-11(21)8-13(22)23-6-2/h7H,5-6,8-9H2,1-4H3
InChIKey CTHQUPHZYJZAJF-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_10609
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: UZI/1262767; Labnumber: KUZ0508; UZI_ID: UZI-010611
Temperature 308 °C