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3-[(4Z)-4-(3-chloro-4-hydroxy-5-methoxybenzylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]propanenitrile
SpectraBase Compound ID FakovhF0dtj
InChI InChI=1S/C15H14ClN3O3/c1-9-11(15(21)19(18-9)5-3-4-17)6-10-7-12(16)14(20)13(8-10)22-2/h6-8,20H,3,5H2,1-2H3/b11-6-
InChIKey BNYLRVDDGVANLE-WDZFZDKYSA-N
Mol Weight 319.75 g/mol
Molecular Formula C15H14ClN3O3
Exact Mass 319.072369 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID H0lHUt41QTh
Name 3-[(4Z)-4-(3-chloro-4-hydroxy-5-methoxybenzylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]propanenitrile
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/C15H14ClN3O3/c1-9-11(15(21)19(18-9)5-3-4-17)6-10-7-12(16)14(20)13(8-10)22-2/h6-8,20H,3,5H2,1-2H3/b11-6-
InChIKey BNYLRVDDGVANLE-WDZFZDKYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_16727
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/8175183; UBI_ID: UBI-016730
Synonyms 3-[4-(3-chloro-4-hydroxy-5-methoxybenzylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]propanenitrile
Temperature 308 °C