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5-Chloro-1-phenyl-3-(trifluoromethyl)-1H-pyrazole-4-carbaldehyde
SpectraBase Compound ID HKqJMdnXbaD
InChI InChI=1S/C11H6ClF3N2O/c12-10-8(6-18)9(11(13,14)15)16-17(10)7-4-2-1-3-5-7/h1-6H
InChIKey OPWVMJDFQNRXIG-UHFFFAOYSA-N
Mol Weight 274.63 g/mol
Molecular Formula C11H6ClF3N2O
Exact Mass 274.012075 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A4zCZ9rsuw8
Name 5-Chloro-1-phenyl-3-(trifluoromethyl)-1H-pyrazole-4-carbaldehyde
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H6ClF3N2O
InChI InChI=1S/C11H6ClF3N2O/c12-10-8(6-18)9(11(13,14)15)16-17(10)7-4-2-1-3-5-7/h1-6H
InChIKey OPWVMJDFQNRXIG-UHFFFAOYSA-N
Instrument Name Shimadzu QP 1000
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.10.183
Molecular Weight 274.630 g/mol
SMILES c1c(cccc1)-[n]1nc(c(c1Cl)C=O)C(F)(F)F
SPLASH splash10-00fr-2090000000-7aab3c7b9f1e0eee3fe0
Source of Spectrum BJO-10-SM2-2
Wiley ID 1853947