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4-[bis(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)methyl]-2-methoxyphenyl 3-methylbenzoate
SpectraBase Compound ID 3rHLcxDq2AW
InChI InChI=1S/C36H32N4O5/c1-22-12-11-13-26(20-22)36(43)45-29-19-18-25(21-30(29)44-4)33(31-23(2)37-39(34(31)41)27-14-7-5-8-15-27)32-24(3)38-40(35(32)42)28-16-9-6-10-17-28/h5-21,33,41-42H,1-4H3
InChIKey VUPSPZGOTMZWKA-UHFFFAOYSA-N
Mol Weight 600.7 g/mol
Molecular Formula C36H32N4O5
Exact Mass 600.23727 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IkQfn92fhSe
Name 4-[bis(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)methyl]-2-methoxyphenyl 3-methylbenzoate
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/C36H32N4O5/c1-22-12-11-13-26(20-22)36(43)45-29-19-18-25(21-30(29)44-4)33(31-23(2)37-39(34(31)41)27-14-7-5-8-15-27)32-24(3)38-40(35(32)42)28-16-9-6-10-17-28/h5-21,33,41-42H,1-4H3
InChIKey VUPSPZGOTMZWKA-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_16037
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: D09831; Labnumber: PETROV-0051; SBI_ID: SBI-016040
Temperature 318 °C