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4-[bis(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)methyl]phenyl 3-nitrobenzoate
SpectraBase Compound ID 41Q2u2E176r
InChI InChI=1S/C34H27N5O6/c1-21-29(32(40)37(35-21)25-11-5-3-6-12-25)31(30-22(2)36-38(33(30)41)26-13-7-4-8-14-26)23-16-18-28(19-17-23)45-34(42)24-10-9-15-27(20-24)39(43)44/h3-20,31,40-41H,1-2H3
InChIKey FZQMHBKIVGZDDW-UHFFFAOYSA-N
Mol Weight 601.6 g/mol
Molecular Formula C34H27N5O6
Exact Mass 601.196134 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CGZOsD27KO5
Name 4-[bis(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)methyl]phenyl 3-nitrobenzoate
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/C34H27N5O6/c1-21-29(32(40)37(35-21)25-11-5-3-6-12-25)31(30-22(2)36-38(33(30)41)26-13-7-4-8-14-26)23-16-18-28(19-17-23)45-34(42)24-10-9-15-27(20-24)39(43)44/h3-20,31,40-41H,1-2H3
InChIKey FZQMHBKIVGZDDW-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_505
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: C30026; Labnumber: PETROV-0054; SBI_ID: SBI-000507
Temperature 318 °C