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3-[(2E)-3-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-2-propenoyl]-4-hydroxy-6-methyl-2H-pyran-2-one
SpectraBase Compound ID 9zCndsx2uKb
InChI InChI=1S/C16H18N2O4/c1-5-18-11(4)12(10(3)17-18)6-7-13(19)15-14(20)8-9(2)22-16(15)21/h6-8,20H,5H2,1-4H3/b7-6+
InChIKey NWTPDUKWLQKFDL-VOTSOKGWSA-N
Mol Weight 302.33 g/mol
Molecular Formula C16H18N2O4
Exact Mass 302.126657 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Au6IWyFmXz9
Name 3-[(2E)-3-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-2-propenoyl]-4-hydroxy-6-methyl-2H-pyran-2-one
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/C16H18N2O4/c1-5-18-11(4)12(10(3)17-18)6-7-13(19)15-14(20)8-9(2)22-16(15)21/h6-8,20H,5H2,1-4H3/b7-6+
InChIKey NWTPDUKWLQKFDL-VOTSOKGWSA-N
NMR Offset 17.912
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_29948
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: 1426633; SBI_ID: SBI-029952
Synonyms 3-[3-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-2-propenoyl]-4-hydroxy-6-methyl-2H-pyran-2-one
Temperature 303 °C