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1-[(3-chloro-1-benzothien-2-yl)carbonyl]-3,5-bis(difluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol
SpectraBase Compound ID DntIiF45CpV
InChI InChI=1S/C14H9ClF4N2O2S/c15-9-6-3-1-2-4-8(6)24-10(9)12(22)21-14(23,13(18)19)5-7(20-21)11(16)17/h1-4,11,13,23H,5H2
InChIKey XZLZPPZPCPTBEU-UHFFFAOYSA-N
Mol Weight 380.74 g/mol
Molecular Formula C14H9ClF4N2O2S
Exact Mass 380.000939 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LuWB4XBDJfs
Name 1-[(3-chloro-1-benzothien-2-yl)carbonyl]-3,5-bis(difluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 380.000939062 u
Formula C14H9ClF4N2O2S
InChI InChI=1S/C14H9ClF4N2O2S/c15-9-6-3-1-2-4-8(6)24-10(9)12(22)21-14(23,13(18)19)5-7(20-21)11(16)17/h1-4,11,13,23H,5H2
InChIKey XZLZPPZPCPTBEU-UHFFFAOYSA-N
Molecular Weight 380.745 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_3425
Solvent DMSO-d6
Source Vendor ID: NMR/12289273