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4-bromo-3,5-dimethyl-1-{4-[(4-propylphenoxy)methyl]benzoyl}-1H-pyrazole
SpectraBase Compound ID H3VakGp5iwL
InChI InChI=1S/C22H23BrN2O2/c1-4-5-17-8-12-20(13-9-17)27-14-18-6-10-19(11-7-18)22(26)25-16(3)21(23)15(2)24-25/h6-13H,4-5,14H2,1-3H3
InChIKey JPEGVYSIFUPPNU-UHFFFAOYSA-N
Mol Weight 427.34 g/mol
Molecular Formula C22H23BrN2O2
Exact Mass 426.094291 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID B35FOP99lCv
Name 4-bromo-3,5-dimethyl-1-{4-[(4-propylphenoxy)methyl]benzoyl}-1H-pyrazole
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/C22H23BrN2O2/c1-4-5-17-8-12-20(13-9-17)27-14-18-6-10-19(11-7-18)22(26)25-16(3)21(23)15(2)24-25/h6-13H,4-5,14H2,1-3H3
InChIKey JPEGVYSIFUPPNU-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_34589
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: 9096814; SBI_ID: SBI-034593
Synonyms 4-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]benzyl 4-propylphenyl ether
Temperature 318 °C