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5-[(E)-(2-(3-chlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene)methyl]-2-methoxyphenyl 2-methylpropanoate
SpectraBase Compound ID LbdqiQLzDWv
InChI InChI=1S/C21H18ClNO5/c1-12(2)20(24)27-18-10-13(7-8-17(18)26-3)9-16-21(25)28-19(23-16)14-5-4-6-15(22)11-14/h4-12H,1-3H3/b16-9+
InChIKey PDSQNNWZDQSUCI-CXUHLZMHSA-N
Mol Weight 399.83 g/mol
Molecular Formula C21H18ClNO5
Exact Mass 399.08735 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LAU4zZIsJlL
Name 5-[(E)-(2-(3-chlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene)methyl]-2-methoxyphenyl 2-methylpropanoate
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/C21H18ClNO5/c1-12(2)20(24)27-18-10-13(7-8-17(18)26-3)9-16-21(25)28-19(23-16)14-5-4-6-15(22)11-14/h4-12H,1-3H3/b16-9+
InChIKey PDSQNNWZDQSUCI-CXUHLZMHSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_17641
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/9063452; UBI_ID: UBI-017644
Synonyms 5-[(2-(3-chlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene)methyl]-2-methoxyphenyl 2-methylpropanoate
Temperature 313 °C