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

*Links on SpectraBase are not permalinks.

1-benzoyl-3-tert-butyl-5-(1,1,2,2,3,3,3-heptafluoropropyl)-4,5-dihydro-1H-pyrazol-5-ol

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1-benzoyl-3-tert-butyl-5-(1,1,2,2,3,3,3-heptafluoropropyl)-4,5-dihydro-1H-pyrazol-5-ol
SpectraBase Compound ID 8OihZLSmkgD
InChI InChI=1S/C17H17F7N2O2/c1-13(2,3)11-9-14(28,15(18,19)16(20,21)17(22,23)24)26(25-11)12(27)10-7-5-4-6-8-10/h4-8,28H,9H2,1-3H3
InChIKey KBQLLSCRGYKCLH-UHFFFAOYSA-N
Mol Weight 414.32 g/mol
Molecular Formula C17H17F7N2O2
Exact Mass 414.117825 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 1IZzw3j95fw
Name 1-benzoyl-3-tert-butyl-5-(1,1,2,2,3,3,3-heptafluoropropyl)-4,5-dihydro-1H-pyrazol-5-ol
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/C17H17F7N2O2/c1-13(2,3)11-9-14(28,15(18,19)16(20,21)17(22,23)24)26(25-11)12(27)10-7-5-4-6-8-10/h4-8,28H,9H2,1-3H3
InChIKey KBQLLSCRGYKCLH-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_3223
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: NMR/10211465; Labnumber: LD-0200056