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(3E)-4-[5-(4-methoxyphenyl)-3-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-3-penten-2-one
SpectraBase Compound ID 87NWZoTkRMl
InChI InChI=1S/C21H21N3O4/c1-14(11-15(2)25)23-21(16-7-9-19(28-3)10-8-16)13-20(22-23)17-5-4-6-18(12-17)24(26)27/h4-12,21H,13H2,1-3H3/b14-11+
InChIKey BAYOSZTXLRQJFP-SDNWHVSQSA-N
Mol Weight 379.42 g/mol
Molecular Formula C21H21N3O4
Exact Mass 379.153206 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GZbh84UCQlp
Name (3E)-4-[5-(4-methoxyphenyl)-3-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-3-penten-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/C21H21N3O4/c1-14(11-15(2)25)23-21(16-7-9-19(28-3)10-8-16)13-20(22-23)17-5-4-6-18(12-17)24(26)27/h4-12,21H,13H2,1-3H3/b14-11+
InChIKey BAYOSZTXLRQJFP-SDNWHVSQSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_3745
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: 115806; Labnumber: MLS-144; VK_ID: VK-003746
Synonyms 4-[5-(4-methoxyphenyl)-3-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-3-penten-2-one
Temperature 308 °C