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(2E)-3-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-1-(4-iodophenyl)-2-propen-1-one

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(2E)-3-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-1-(4-iodophenyl)-2-propen-1-one
SpectraBase Compound ID JYNBgDHPD7P
InChI InChI=1S/C16H17IN2O/c1-4-19-12(3)15(11(2)18-19)9-10-16(20)13-5-7-14(17)8-6-13/h5-10H,4H2,1-3H3/b10-9+
InChIKey VIXNNFLPGMNGBR-MDZDMXLPSA-N
Mol Weight 380.23 g/mol
Molecular Formula C16H17IN2O
Exact Mass 380.038558 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6rvAQ92XYWK
Name (2E)-3-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-1-(4-iodophenyl)-2-propen-1-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/C16H17IN2O/c1-4-19-12(3)15(11(2)18-19)9-10-16(20)13-5-7-14(17)8-6-13/h5-10H,4H2,1-3H3/b10-9+
InChIKey VIXNNFLPGMNGBR-MDZDMXLPSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_15039
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/1023043; UBI_ID: UBI-015042
Synonyms 3-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-1-(4-iodophenyl)-2-propen-1-one
Temperature 306 °C