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1-Phenyl-3-trifluoromethyl-2-pyrazolin-5-one
SpectraBase Compound ID 2svl0wVq35y
InChI InChI=1S/C10H7F3N2O/c11-10(12,13)8-6-9(16)15(14-8)7-4-2-1-3-5-7/h1-5H,6H2
InChIKey GLGRRRKQSFURGD-UHFFFAOYSA-N
Mol Weight 228.17 g/mol
Molecular Formula C10H7F3N2O
Exact Mass 228.051047 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 26ZiecoJkZU
Name 2-phenyl-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H7F3N2O
GC Oven Program Split/splitless injector
InChI InChI=1S/C10H7F3N2O/c11-10(12,13)8-6-9(16)15(14-8)7-4-2-1-3-5-7/h1-5H,6H2
InChIKey GLGRRRKQSFURGD-UHFFFAOYSA-N
Instrument Name Thermo Scientific ISQ
Ionization Type EI
Literature Reference DOI 10.1002/anie.202100115
Molecular Weight 228.174 g/mol
SMILES c1(ccccc1)N1N=C(CC1=O)C(F)(F)F
SPLASH splash10-004i-5290000000-013e0634757d5ce040c9
Source of Spectrum ACI-60-SM5-S3
Wiley ID 1882429