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

*Links on SpectraBase are not permalinks.
benzamide, 4-chloro-N-[1-(2,3-dihydro-5-methyl-3-oxo-1H-pyrazol-4-yl)-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-
SpectraBase Compound ID 4J4KBBBZozN
InChI InChI=1S/C14H10ClF6N3O2/c1-6-9(11(26)24-23-6)12(13(16,17)18,14(19,20)21)22-10(25)7-2-4-8(15)5-3-7/h2-5H,1H3,(H,22,25)(H2,23,24,26)
InChIKey LTAAPAPZZDTWAA-UHFFFAOYSA-N
Mol Weight 401.7 g/mol
Molecular Formula C14H10ClF6N3O2
Exact Mass 401.036573 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 D8nUnGduYn6
Name benzamide, 4-chloro-N-[1-(2,3-dihydro-5-methyl-3-oxo-1H-pyrazol-4-yl)-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 401.036573250 u
Formula C14H10ClF6N3O2
InChI InChI=1S/C14H10ClF6N3O2/c1-6-9(11(26)24-23-6)12(13(16,17)18,14(19,20)21)22-10(25)7-2-4-8(15)5-3-7/h2-5H,1H3,(H,22,25)(H2,23,24,26)
InChIKey LTAAPAPZZDTWAA-UHFFFAOYSA-N
Molecular Weight 401.696 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8478
Solvent DMSO-d6
Source Vendor ID: NMR/9322545; Lab Info: AU; Lab Number: AU-T000798