For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(7E)-7-benzylidene-2-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}-3-phenyl-3,3a,4,5,6,7-hexahydro-2H-indazole
SpectraBase Compound ID EN8SYtzfez1
InChI InChI=1S/C27H25F3N4O/c1-18-15-23(27(28,29)30)31-33(18)17-24(35)34-26(20-11-6-3-7-12-20)22-14-8-13-21(25(22)32-34)16-19-9-4-2-5-10-19/h2-7,9-12,15-16,22,26H,8,13-14,17H2,1H3/b21-16+
InChIKey OUAVMRHESZIHQC-LTGZKZEYSA-N
Mol Weight 478.52 g/mol
Molecular Formula C27H25F3N4O
Exact Mass 478.198046 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 3cEXUCuweMq
Name (7E)-7-benzylidene-2-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}-3-phenyl-3,3a,4,5,6,7-hexahydro-2H-indazole
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/C27H25F3N4O/c1-18-15-23(27(28,29)30)31-33(18)17-24(35)34-26(20-11-6-3-7-12-20)22-14-8-13-21(25(22)32-34)16-19-9-4-2-5-10-19/h2-7,9-12,15-16,22,26H,8,13-14,17H2,1H3/b21-16+
InChIKey OUAVMRHESZIHQC-LTGZKZEYSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_9032
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/1023603; Labnumber: Gbb0210; UZI_ID: UZI-009034
Synonyms 7-benzylidene-2-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}-3-phenyl-3,3a,4,5,6,7-hexahydro-2H-indazole
Temperature 308 °C