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2-(5-bromo-4-{(E)-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)imino]methyl}-2-methoxyphenoxy)acetamide
SpectraBase Compound ID LqezVgFFkWK
InChI InChI=1S/C21H21BrN4O4/c1-13-20(21(28)26(25(13)2)15-7-5-4-6-8-15)24-11-14-9-17(29-3)18(10-16(14)22)30-12-19(23)27/h4-11H,12H2,1-3H3,(H2,23,27)/b24-11+
InChIKey XEOHCMGMINQOSE-BHGWPJFGSA-N
Mol Weight 473.33 g/mol
Molecular Formula C21H21BrN4O4
Exact Mass 472.074618 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7g2ssxexnP0
Name 2-(5-bromo-4-{(E)-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)imino]methyl}-2-methoxyphenoxy)acetamide
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/C21H21BrN4O4/c1-13-20(21(28)26(25(13)2)15-7-5-4-6-8-15)24-11-14-9-17(29-3)18(10-16(14)22)30-12-19(23)27/h4-11H,12H2,1-3H3,(H2,23,27)/b24-11+
InChIKey XEOHCMGMINQOSE-BHGWPJFGSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_5318
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/9051514; Labnumber: BMWA-160495; UZI_ID: UZI-005320
Synonyms 2-(5-bromo-4-{[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)imino]methyl}-2-methoxyphenoxy)acetamide
Temperature 308 °C