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ethyl ({(4E)-4-[(1,5-dimethyl-1H-pyrazol-4-yl)methylene]-1-ethyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetate
SpectraBase Compound ID 1u8b1ZrEf4v
InChI InChI=1S/C15H20N4O3S/c1-5-19-14(21)12(7-11-8-16-18(4)10(11)3)17-15(19)23-9-13(20)22-6-2/h7-8H,5-6,9H2,1-4H3/b12-7+
InChIKey AKSRIYMXABQRJP-KPKJPENVSA-N
Mol Weight 336.41 g/mol
Molecular Formula C15H20N4O3S
Exact Mass 336.125612 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3aT2OWIjAz9
Name ethyl ({(4E)-4-[(1,5-dimethyl-1H-pyrazol-4-yl)methylene]-1-ethyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetate
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/C15H20N4O3S/c1-5-19-14(21)12(7-11-8-16-18(4)10(11)3)17-15(19)23-9-13(20)22-6-2/h7-8H,5-6,9H2,1-4H3/b12-7+
InChIKey AKSRIYMXABQRJP-KPKJPENVSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_11452
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/1263490; Labnumber: NIV1307; UZI_ID: UZI-011454
Synonyms ethyl ({4-[(1,5-dimethyl-1H-pyrazol-4-yl)methylene]-1-ethyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetate
Temperature 308 °C