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N-[1-(4-fluorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-9H-xanthene-9-carboxamide
SpectraBase Compound ID 8rtLJ8mA9g1
InChI InChI=1S/C26H22FN3O2/c1-16-25(17(2)30(29-16)15-18-11-13-19(27)14-12-18)28-26(31)24-20-7-3-5-9-22(20)32-23-10-6-4-8-21(23)24/h3-14,24H,15H2,1-2H3,(H,28,31)
InChIKey PFEYBICTBIVMCI-UHFFFAOYSA-N
Mol Weight 427.48 g/mol
Molecular Formula C26H22FN3O2
Exact Mass 427.169605 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KjCnQKAfyw8
Name N-[1-(4-fluorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-9H-xanthene-9-carboxamide
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/C26H22FN3O2/c1-16-25(17(2)30(29-16)15-18-11-13-19(27)14-12-18)28-26(31)24-20-7-3-5-9-22(20)32-23-10-6-4-8-21(23)24/h3-14,24H,15H2,1-2H3,(H,28,31)
InChIKey PFEYBICTBIVMCI-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_4102
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/9171311; Labnumber: BAM_UACK/002433; UZI_ID: UZI-004104
Temperature 308 °C